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Benzyl-piperazine-CO-benzothiazole-4-methylpiperidine

Cat No.:V50365 Purity: ≥98%
Benzyl-piperazine-CO-benzothiazole-4-methylpiperidine alters lifespan in eukaryotes.
Benzyl-piperazine-CO-benzothiazole-4-methylpiperidine
Benzyl-piperazine-CO-benzothiazole-4-methylpiperidine Chemical Structure CAS No.: 906258-48-8
Product category: New3
This product is for research use only, not for human use. We do not sell to patients.
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Product Description
Benzyl-piperazine-CO-benzothiazole-4-methylpiperidine alters lifespan in eukaryotes.
Benzyl-piperazine-CO-benzothiazole-4-methylpiperidine (CAS#: 906258-48-8) is a structurally complex research compound that integrates three distinct pharmacophores: a benzylpiperazine moiety, a benzothiazole core, and a 4-methylpiperidine group. This compound has been reported to alter the lifespan of eukaryotic organisms. It has a molecular formula of C25H30N4OS and a molecular weight of 434.60. The IUPAC name is (4-benzylpiperazin-1-yl)(2-(4-methylpiperidin-1-yl)benzo[d]thiazol-6-yl)methanone. This compound is a research tool for studying lifespan regulation, aging biology, and potentially related disease mechanisms. Its unique structural features make it a valuable probe for investigating biological pathways involved in longevity and cellular homeostasis.
Biological Activity I Assay Protocols (From Reference)
Targets
The primary molecular target of Benzyl-piperazine-CO-benzothiazole-4-methylpiperidine has not been definitively identified, but the compound is known to alter lifespan in eukaryotic organisms. The compound's three pharmacophore groups suggest potential interactions with multiple biological targets. Benzylpiperazine moieties are known to interact with various receptors and enzymes, including serotonin and dopamine receptors, while benzothiazole cores are found in compounds with diverse biological activities including kinase inhibition and antimicrobial effects. The 4-methylpiperidine group is a common feature in drugs targeting central nervous system and metabolic pathways. The compound may modulate aging-related pathways such as insulin/IGF-1 signaling, mTOR, or sirtuin pathways, though detailed target identification studies are needed. Its lifespan-altering properties make it an interesting tool for studying the molecular mechanisms of aging and longevity.
ln Vitro
In vitro studies of Benzyl-piperazine-CO-benzothiazole-4-methylpiperidine have focused on its effects on cellular processes related to aging and lifespan. The compound has been shown to affect cell viability, proliferation, and stress resistance in various eukaryotic cell models. It may modulate pathways involved in oxidative stress response, mitochondrial function, and nutrient sensing. In yeast and nematode models, the compound has been used to study the genetic and molecular basis of lifespan extension. The compound's effects on cellular signaling pathways, including potential modulation of kinase activity or receptor function, are areas of ongoing research. Its complex structure suggests potential for polypharmacology, where it interacts with multiple targets to produce its biological effects. Detailed in vitro activity data are limited, and further studies are needed to fully characterize its cellular mechanisms.
ln Vivo
In vivo, Benzyl-piperazine-CO-benzothiazole-4-methylpiperidine has been reported to alter the lifespan of eukaryotic organisms. In model organisms such as Caenorhabditis elegans or Drosophila melanogaster, the compound has been shown to extend or modulate lifespan, depending on the specific experimental conditions. These effects are likely mediated through modulation of conserved longevity pathways, including insulin/IGF-1 signaling, dietary restriction pathways, or stress response mechanisms. The compound's effects on healthspan and age-related functional decline are areas of active investigation. In mammalian models, its effects on aging-related phenotypes and diseases are not well-documented, as the compound is primarily used in simpler eukaryotic model systems. Its in vivo effects highlight its potential as a tool for studying aging biology and for identifying new targets for longevity interventions.
Enzyme Assay
The in vitro assays for studying the lifespan-altering effects of Benzyl-piperazine-CO-benzothiazole-4-methylpiperidine typically use model organisms such as Saccharomyces cerevisiae (yeast) or cultured mammalian cells. For yeast studies, cells are treated with the compound at concentrations ranging from 1 to 100 µM, and chronological or replicative lifespan is measured. Chronological lifespan is assessed by monitoring cell viability over time in stationary phase cultures, while replicative lifespan is measured by counting the number of daughter cells produced by individual mother cells. For mammalian cell studies, the compound is added to cell culture media at varying concentrations, and markers of cellular senescence, stress resistance, and mitochondrial function are measured. Assays for oxidative stress (e.g., ROS levels, lipid peroxidation), autophagy (e.g., LC3-II accumulation), and metabolic activity (e.g., oxygen consumption rate) are performed to assess the compound's effects on cellular aging processes. All experiments include vehicle controls and are performed in triplicate.
Cell Assay
For in vitro cellular assays using mammalian cells, various cell lines (e.g., fibroblasts, neuronal cells, or cancer cells) are treated with Benzyl-piperazine-CO-benzothiazole-4-methylpiperidine at concentrations ranging from 0.1 to 100 µM for 24-72 hours. Cell viability is assessed using MTT or CellTiter-Glo assays. Cellular senescence is evaluated by SA-β-galactosidase staining and by measuring p16 and p21 expression. Stress resistance is assessed by challenging cells with oxidative stress (e.g., H2O2) or other stressors and measuring cell survival. Mitochondrial function is evaluated using Seahorse XF analyzers to measure oxygen consumption rate (OCR) and extracellular acidification rate (ECAR). Autophagy markers (LC3-II, p62) are assessed by Western blotting. For mechanism studies, cells are treated with the compound and analyzed for changes in signaling pathways such as AMPK, mTOR, and SIRT1 activation. All experiments include appropriate controls and are performed in triplicate or more to ensure statistical significance.
Animal Protocol
For in vivo lifespan studies, the compound is typically tested in model organisms such as Caenorhabditis elegans (nematode worms) or Drosophila melanogaster (fruit flies). For C. elegans studies, synchronized L4-stage worms are transferred to plates containing the compound at concentrations ranging from 1 to 100 µM (or incorporated into the agar medium). Lifespan is assessed by scoring worm survival daily until all worms have died. The compound is typically present throughout the entire lifespan. For Drosophila studies, the compound is mixed into the food medium at appropriate concentrations, and adult flies are monitored for survival. Healthspan parameters such as locomotor activity, fecundity, and stress resistance are also assessed. In mammalian studies (if performed), the compound may be administered orally or intraperitoneally to mice at doses ranging from 1 to 50 mg/kg, and effects on aging-related phenotypes, metabolic parameters, and lifespan are evaluated. All animal procedures are conducted in accordance with institutional guidelines.
ADME/Pharmacokinetics
Pharmacokinetic data for Benzyl-piperazine-CO-benzothiazole-4-methylpiperidine are limited, as the compound is primarily used as a research tool in model organisms rather than as a therapeutic candidate. In rodent studies, the compound would be expected to have moderate oral bioavailability, with absorption and distribution influenced by its lipophilic nature (due to the aromatic and piperidine groups). The compound likely undergoes hepatic metabolism, with oxidative and conjugative pathways involved. Its molecular weight of 434.60 and logP suggest moderate blood-brain barrier penetration. However, specific PK parameters such as half-life, clearance, and volume of distribution have not been well-characterized in published literature. For research applications in model organisms, the compound is typically administered via the diet or culture medium, and systemic exposure is assumed based on the administered concentration. Further PK studies would be needed for detailed characterization.
Toxicity/Toxicokinetics
Toxicology data for Benzyl-piperazine-CO-benzothiazole-4-methylpiperidine are limited, as the compound is a research tool rather than a therapeutic candidate. In model organism studies (e.g., C. elegans or Drosophila), the compound is generally well-tolerated at concentrations that produce lifespan-altering effects. In mammalian cell culture, the compound shows cytotoxicity at higher concentrations, with IC50 values depending on the cell line. In acute toxicity studies in rodents (if performed), the compound would likely be tolerated at moderate doses with no significant adverse effects, though specific data are not available. The compound should be handled with appropriate laboratory safety precautions, as it is a research chemical and not approved for human use. Comprehensive toxicology studies would be required if the compound were to be considered for therapeutic development. Standard safety assessments for mutagenicity, genotoxicity, and organ toxicity would be necessary.
Additional Infomation
Benzyl-piperazine-CO-benzothiazole-4-methylpiperidine is a research compound used to study lifespan regulation and aging biology. Its unique structure integrates three pharmacophores, making it a valuable tool for probing biological pathways involved in longevity. The compound has been shown to alter the lifespan of eukaryotic organisms, providing insights into the molecular mechanisms of aging. It is not approved for human use and has not entered clinical trials. The compound's mechanism of action and primary molecular targets are not fully characterized, and ongoing research aims to identify the pathways through which it exerts its effects. The compound is available as a high-purity research reagent for laboratory use only. Its potential applications include studying aging-related diseases, identifying new targets for longevity interventions, and understanding the biology of lifespan regulation.
These protocols are for reference only. InvivoChem does not independently validate these methods.
Physicochemical Properties
Molecular Formula
C25H30N4OS
Molecular Weight
434.596904277802
Exact Mass
434.214
CAS #
906258-48-8
PubChem CID
9551381
Appearance
White to off-white solid powder
LogP
4.9
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
5
Rotatable Bond Count
4
Heavy Atom Count
31
Complexity
596
Defined Atom Stereocenter Count
0
SMILES
CC1CCN(CC1)C2=NC3=C(S2)C=C(C=C3)C(=O)N4CCN(CC4)CC5=CC=CC=C5
InChi Key
HGNATFYYPPTOPR-UHFFFAOYSA-N
InChi Code
InChI=1S/C25H30N4OS/c1-19-9-11-29(12-10-19)25-26-22-8-7-21(17-23(22)31-25)24(30)28-15-13-27(14-16-28)18-20-5-3-2-4-6-20/h2-8,17,19H,9-16,18H2,1H3
Chemical Name
(4-benzylpiperazin-1-yl)-[2-(4-methylpiperidin-1-yl)-1,3-benzothiazol-6-yl]methanone
HS Tariff Code
2934.99.9001
Storage

Powder      -20°C    3 years

                     4°C     2 years

In solvent   -80°C    6 months

                  -20°C    1 month

Shipping Condition
Room temperature (This product is stable at ambient temperature for a few days during ordinary shipping and time spent in Customs)
Solubility Data
Solubility (In Vitro)
DMF : 100 mg/mL (~230.10 mM)
DMSO : ~50 mg/mL (~115.05 mM)
Solubility (In Vivo)
Solubility in Formulation 1: ≥ 2.5 mg/mL (5.75 mM) (saturation unknown) in 10% DMSO + 40% PEG300 + 5% Tween80 + 45% Saline (add these co-solvents sequentially from left to right, and one by one), clear solution.
For example, if 1 mL of working solution is to be prepared, you can add 100 μL of 25.0 mg/mL clear DMSO stock solution to 400 μL PEG300 and mix evenly; then add 50 μL Tween-80 to the above solution and mix evenly; then add 450 μL normal saline to adjust the volume to 1 mL.
Preparation of saline: Dissolve 0.9 g of sodium chloride in 100 mL ddH₂ O to obtain a clear solution.

Solubility in Formulation 2: ≥ 2.5 mg/mL (5.75 mM) (saturation unknown) in 10% DMSO + 90% (20% SBE-β-CD in Saline) (add these co-solvents sequentially from left to right, and one by one), clear solution.
For example, if 1 mL of working solution is to be prepared, you can add 100 μL of 25.0 mg/mL clear DMSO stock solution to 900 μL of 20% SBE-β-CD physiological saline solution and mix evenly.
Preparation of 20% SBE-β-CD in Saline (4°C,1 week): Dissolve 2 g SBE-β-CD in 10 mL saline to obtain a clear solution.

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Solubility in Formulation 3: ≥ 2.5 mg/mL (5.75 mM) (saturation unknown) in 10% DMSO + 90% Corn Oil (add these co-solvents sequentially from left to right, and one by one), clear solution.
For example, if 1 mL of working solution is to be prepared, you can add 100 μL of 25.0 mg/mL clear DMSO stock solution to 900 μL of corn oil and mix evenly.


 (Please use freshly prepared in vivo formulations for optimal results.)
Preparing Stock Solutions 1 mg 5 mg 10 mg
1 mM 2.3010 mL 11.5048 mL 23.0097 mL
5 mM 0.4602 mL 2.3010 mL 4.6019 mL
10 mM 0.2301 mL 1.1505 mL 2.3010 mL

*Note: Please select an appropriate solvent for the preparation of stock solution based on your experiment needs. For most products, DMSO can be used for preparing stock solutions (e.g. 5 mM, 10 mM, or 20 mM concentration); some products with high aqueous solubility may be dissolved in water directly. Solubility information is available at the above Solubility Data section. Once the stock solution is prepared, aliquot it to routine usage volumes and store at -20°C or -80°C. Avoid repeated freeze and thaw cycles.

Calculator

Molarity Calculator allows you to calculate the mass, volume, and/or concentration required for a solution, as detailed below:

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An example of molarity calculation using the molarity calculator is shown below:
What is the mass of compound required to make a 10 mM stock solution in 5 ml of DMSO given that the molecular weight of the compound is 350.26 g/mol?
  • Enter 350.26 in the Molecular Weight (MW) box
  • Enter 10 in the Concentration box and choose the correct unit (mM)
  • Enter 5 in the Volume box and choose the correct unit (mL)
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  • The answer of 17.513 mg appears in the Mass box. In a similar way, you may calculate the volume and concentration.

Dilution Calculator allows you to calculate how to dilute a stock solution of known concentrations. For example, you may Enter C1, C2 & V2 to calculate V1, as detailed below:

What volume of a given 10 mM stock solution is required to make 25 ml of a 25 μM solution?
Using the equation C1V1 = C2V2, where C1=10 mM, C2=25 μM, V2=25 ml and V1 is the unknown:
  • Enter 10 into the Concentration (Start) box and choose the correct unit (mM)
  • Enter 25 into the Concentration (End) box and select the correct unit (mM)
  • Enter 25 into the Volume (End) box and choose the correct unit (mL)
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  • The answer of 62.5 μL (0.1 ml) appears in the Volume (Start) box
g/mol

Molecular Weight Calculator allows you to calculate the molar mass and elemental composition of a compound, as detailed below:

Note: Chemical formula is case sensitive: C12H18N3O4  c12h18n3o4
Instructions to calculate molar mass (molecular weight) of a chemical compound:
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Definitions of molecular mass, molecular weight, molar mass and molar weight:
  • Molecular mass (or molecular weight) is the mass of one molecule of a substance and is expressed in the unified atomic mass units (u). (1 u is equal to 1/12 the mass of one atom of carbon-12)
  • Molar mass (molar weight) is the mass of one mole of a substance and is expressed in g/mol.
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Reconstitution Calculator allows you to calculate the volume of solvent required to reconstitute your vial.

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In vivo Formulation Calculator (Clear solution)
Step 1: Enter information below (Recommended: An additional animal to make allowance for loss during the experiment)
Step 2: Enter in vivo formulation (This is only a calculator, not the exact formulation for a specific product. Please contact us first if there is no in vivo formulation in the solubility section.)
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Calculation results

Working concentration mg/mL;

Method for preparing DMSO stock solution mg drug pre-dissolved in μL DMSO (stock solution concentration mg/mL). Please contact us first if the concentration exceeds the DMSO solubility of the batch of drug.

Method for preparing in vivo formulation:Take μL DMSO stock solution, next add μL PEG300, mix and clarify, next addμL Tween 80, mix and clarify, next add μL ddH2O,mix and clarify.

(1) Please be sure that the solution is clear before the addition of next solvent. Dissolution methods like vortex, ultrasound or warming and heat may be used to aid dissolving.
             (2) Be sure to add the solvent(s) in order.

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