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Clencyclohexerol

Cat No.:V71278 Purity: ≥95%
Clencyclohexerol is a beta-agonist.
Clencyclohexerol
Clencyclohexerol Chemical Structure CAS No.: 157877-79-7
Product category: Adrenergic Receptor
This product is for research use only, not for human use. We do not sell to patients.
Size Price Stock Qty
1mg
Other Sizes

Other Forms of Clencyclohexerol:

  • Clencyclohexerol-d10
Official Supplier of:
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Top Publications Citing lnvivochem Products
Product Description
Clencyclohexerol is a beta-agonist. Clencyclohexerol is used as an animal growth promoter.
Clencyclohexerol is a synthetic compound related to clenbuterol, functioning as a beta-adrenoceptor agonist. It is a long-acting beta2-adrenergic receptor agonist with potent bronchodilatory and anabolic properties, and has been used as a growth promoter in animals. It also has therapeutic potential in muscle wasting disorders.
Biological Activity I Assay Protocols (From Reference)
Targets
β receptor
beta2-adrenergic receptor (agonist)
ln Vitro
Clencyclohexerol is a beta-agonist and an analog of clenbuterol. beta-Adrenoceptor agonists, including clenbuterol, modulate protein synthesis and degradation and have therapeutic potential in muscle wasting disorders. Clencyclohexerol is a long-acting beta2-adrenergic receptor agonist with potent bronchodilatory and anabolic properties.
ln Vivo
Cellular activity data show that Clencyclohexerol acts as a beta-agonist, primarily by stimulating beta2-adrenergic receptors. This leads to smooth muscle relaxation and enhanced airflow in the respiratory tract. Additionally, it has anabolic effects that promote muscle growth and fat reduction, making it relevant for research into muscle wasting disorders and growth promotion.
Enzyme Assay
Radioligand binding assays for beta2-adrenoceptors are performed using membrane preparations from CHO cells expressing human beta2 receptors or rat lung membranes. [3H]-CGP12177 or [¹2⁵I]-cyanopindolol is used as the radioligand. Test compound is incubated with membranes at varying concentrations. Bound radioligand is separated by filtration and counted by scintillation. Ki values are calculated from competition curves to determine binding affinity.
Cell Assay
Cell-based functional assays for beta2-adrenergic agonism use CHO cells expressing human beta2 receptors with a cAMP response element reporter. Cells are seeded in 96-well plates and treated with serial dilutions of Clencyclohexerol. Agonist activity is measured by quantifying intracellular cAMP accumulation via HTRF or ELISA. EC50 is calculated from concentration-response curves. The effect on protein synthesis may be assessed in muscle cell lines.
Animal Protocol
In vivo animal studies for Clencyclohexerol typically involve oral or intravenous administration to rats or mice. Pharmacokinetic parameters are determined from blood samples collected at multiple time points. For growth promotion studies, animals are treated daily for 2-4 weeks and body weight, muscle mass, and feed efficiency are measured. Bronchodilatory effects are assessed in models of induced bronchospasm.
ADME/Pharmacokinetics
Pharmacokinetic data specific to Clencyclohexerol are not fully characterized in the available literature. As a beta2-adrenoceptor agonist related to clenbuterol, it is expected to be orally bioavailable with moderate half-life and distribution to lung and muscle tissues. It may undergo metabolic clearance primarily via hepatic pathways.
Toxicity/Toxicokinetics
As a research compound, toxicity data for Clencyclohexerol are limited. Standard preclinical safety assessment would include acute and repeat-dose toxicity studies in rodents. beta-Agonists are known to cause cardiovascular effects including tachycardia, hypertension, and cardiac hypertrophy at high doses. The compound has been used as a growth promoter in farm animals, raising concerns about residue levels in meat products.
References

[1]. Development and validation of a multi-residue method for determination of 18 β-agonists in bovine urine by UPLC-MS/MS. Microchemical Journal. Volume 115, July 2014, Pages 70-77.

Additional Infomation
Clencyclohexerol is a beta-adrenoceptor agonist and structural analog of clenbuterol. Its long-acting beta2-agonist properties give it potential therapeutic applications in asthma, COPD, and muscle wasting disorders. However, as of current information, it has not received regulatory approval for clinical use in humans. It has been used as a growth promoter in animals, but such use is restricted in many countries due to food safety concerns.
These protocols are for reference only. InvivoChem does not independently validate these methods.
Physicochemical Properties
Molecular Formula
C14H20CL2N2O2
Molecular Weight
319.23
Exact Mass
318.09
CAS #
157877-79-7
Related CAS #
Clencyclohexerol-d10;1346599-61-8
PubChem CID
46783606
Appearance
White to off-white solid powder
Density
1.4±0.1 g/cm3
Boiling Point
514.6±50.0 °C at 760 mmHg
Flash Point
265.0±30.1 °C
Vapour Pressure
0.0±1.4 mmHg at 25°C
Index of Refraction
1.621
LogP
1.74
Hydrogen Bond Donor Count
4
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
4
Heavy Atom Count
20
Complexity
289
Defined Atom Stereocenter Count
0
SMILES
C1CC(CCC1NCC(C2=CC(=C(C(=C2)Cl)N)Cl)O)O
InChi Key
DKFLKXDTRUWFDL-UHFFFAOYSA-N
InChi Code
InChI=1S/C14H20Cl2N2O2/c15-11-5-8(6-12(16)14(11)17)13(20)7-18-9-1-3-10(19)4-2-9/h5-6,9-10,13,18-20H,1-4,7,17H2
Chemical Name
4-[[2-(4-amino-3,5-dichlorophenyl)-2-hydroxyethyl]amino]cyclohexan-1-ol
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)
May dissolve in DMSO (in most cases), if not, try other solvents such as H2O, Ethanol, or DMF with a minute amount of products to avoid loss of samples
Solubility (In Vivo)
Note: Listed below are some common formulations that may be used to formulate products with low water solubility (e.g. < 1 mg/mL), you may test these formulations using a minute amount of products to avoid loss of samples.

Injection Formulations
(e.g. IP/IV/IM/SC)
Injection Formulation 1: DMSO : Tween 80: Saline = 10 : 5 : 85 (i.e. 100 μL DMSO stock solution 50 μL Tween 80 850 μL Saline)
*Preparation of saline: Dissolve 0.9 g of sodium chloride in 100 mL ddH ₂ O to obtain a clear solution.
Injection Formulation 2: DMSO : PEG300Tween 80 : Saline = 10 : 40 : 5 : 45 (i.e. 100 μL DMSO 400 μLPEG300 50 μL Tween 80 450 μL Saline)
Injection Formulation 3: DMSO : Corn oil = 10 : 90 (i.e. 100 μL DMSO 900 μL Corn oil)
Example: Take the Injection Formulation 3 (DMSO : Corn oil = 10 : 90) as an example, if 1 mL of 2.5 mg/mL working solution is to be prepared, you can take 100 μL 25 mg/mL DMSO stock solution and add to 900 μL corn oil, mix well to obtain a clear or suspension solution (2.5 mg/mL, ready for use in animals).
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Injection Formulation 4: DMSO : 20% SBE-β-CD in saline = 10 : 90 [i.e. 100 μL DMSO 900 μL (20% SBE-β-CD in saline)]
*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.
Injection Formulation 5: 2-Hydroxypropyl-β-cyclodextrin : Saline = 50 : 50 (i.e. 500 μL 2-Hydroxypropyl-β-cyclodextrin 500 μL Saline)
Injection Formulation 6: DMSO : PEG300 : castor oil : Saline = 5 : 10 : 20 : 65 (i.e. 50 μL DMSO 100 μLPEG300 200 μL castor oil 650 μL Saline)
Injection Formulation 7: Ethanol : Cremophor : Saline = 10: 10 : 80 (i.e. 100 μL Ethanol 100 μL Cremophor 800 μL Saline)
Injection Formulation 8: Dissolve in Cremophor/Ethanol (50 : 50), then diluted by Saline
Injection Formulation 9: EtOH : Corn oil = 10 : 90 (i.e. 100 μL EtOH 900 μL Corn oil)
Injection Formulation 10: EtOH : PEG300Tween 80 : Saline = 10 : 40 : 5 : 45 (i.e. 100 μL EtOH 400 μLPEG300 50 μL Tween 80 450 μL Saline)


Oral Formulations
Oral Formulation 1: Suspend in 0.5% CMC Na (carboxymethylcellulose sodium)
Oral Formulation 2: Suspend in 0.5% Carboxymethyl cellulose
Example: Take the Oral Formulation 1 (Suspend in 0.5% CMC Na) as an example, if 100 mL of 2.5 mg/mL working solution is to be prepared, you can first prepare 0.5% CMC Na solution by measuring 0.5 g CMC Na and dissolve it in 100 mL ddH2O to obtain a clear solution; then add 250 mg of the product to 100 mL 0.5% CMC Na solution, to make the suspension solution (2.5 mg/mL, ready for use in animals).
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Oral Formulation 3: Dissolved in PEG400
Oral Formulation 4: Suspend in 0.2% Carboxymethyl cellulose
Oral Formulation 5: Dissolve in 0.25% Tween 80 and 0.5% Carboxymethyl cellulose
Oral Formulation 6: Mixing with food powders


Note: Please be aware that the above formulations are for reference only. InvivoChem strongly recommends customers to read literature methods/protocols carefully before determining which formulation you should use for in vivo studies, as different compounds have different solubility properties and have to be formulated differently.

 (Please use freshly prepared in vivo formulations for optimal results.)
Preparing Stock Solutions 1 mg 5 mg 10 mg
1 mM 3.1325 mL 15.6627 mL 31.3254 mL
5 mM 0.6265 mL 3.1325 mL 6.2651 mL
10 mM 0.3133 mL 1.5663 mL 3.1325 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:

  • Calculate the Mass of a compound required to prepare a solution of known volume and concentration
  • Calculate the Volume of solution required to dissolve a compound of known mass to a desired concentration
  • Calculate the Concentration of a solution resulting from a known mass of compound in a specific volume
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)
  • Click the “Calculate” button
  • 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)
  • Click the “Calculate” button
  • 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:
  • To calculate molar mass of a chemical compound, please enter the chemical/molecular formula and click the “Calculate’ button.
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.

  • Enter the mass of the reagent and the desired reconstitution concentration as well as the correct units
  • Click the “Calculate” button
  • The answer appears in the Volume (to add to vial) box
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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