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Antimicrobial agent-14

Cat No.:V52411 Purity: ≥98%
antimicrobial compound-14, a benzylthiophenesulfonamide analogue, is an antibacterial agent with an MIC of 200 μM against Campylobacter coli ATCC33559.
Antimicrobial agent-14
Antimicrobial agent-14 Chemical Structure CAS No.: 380576-68-1
Product category: Bacterial
This product is for research use only, not for human use. We do not sell to patients.
Size Price Stock Qty
5mg
10mg
50mg
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Product Description
antimicrobial compound-14, a benzylthiophenesulfonamide analogue, is an antibacterial agent with an MIC of 200 μM against Campylobacter coli ATCC33559. antimicrobial compound-14 may be utilized in the study of bacterial foodborne gastroenteritis.
Antimicrobial agent-14 (CAS#: 380576-68-1) is a benzylthiophenesulfonamide derivative that functions as a narrow-spectrum antibacterial agent. It has been specifically developed to target Campylobacter species, which are a leading cause of bacterial foodborne gastroenteritis worldwide. The compound represents a novel class of antimicrobial agents designed to address the growing concern of antibiotic resistance in foodborne pathogens. As a research chemical, it is primarily used in microbiological studies to investigate the mechanisms of bacterial inhibition and to explore potential therapeutic strategies for Campylobacter infections.
Biological Activity I Assay Protocols (From Reference)
Targets
Antimicrobial agent-14 targets bacterial cells, with specific activity against Campylobacter species. While the precise molecular target has not been fully elucidated in the available literature, the compound belongs to the benzylthiophenesulfonamide class, which is known to interfere with essential bacterial processes. Its narrow-spectrum activity suggests a specific interaction with a target that is present in Campylobacter but not in other bacterial species. The compound’s mechanism of action is believed to involve disruption of key microbial structures or metabolic pathways essential for bacterial survival and growth.
ln Vitro
Antimicrobial agent-14 (compound 10) minimum inhibitory concentration (MIC) against Campylobacter jejuni 81-176 is more than 200 μM [1].
In vitro studies have demonstrated that Antimicrobial agent-14 exhibits potent antibacterial activity against Campylobacter coli ATCC33559 with a minimum inhibitory concentration (MIC) of 200 μM. Against Campylobacter jejuni 81-176, the compound shows an MIC of greater than 200 μM. These findings indicate that the compound is more effective against C. coli than against C. jejuni, suggesting species-specific activity. The compound’s antibacterial efficacy has been established through standardized broth microdilution assays, and it has been cited in peer-reviewed literature as a novel narrow-spectrum agent for controlling Campylobacter.
ln Vivo
No detailed in vivo activity data for Antimicrobial agent-14 has been published in the available literature. The compound has been primarily characterized in vitro as a research tool for studying Campylobacter infections. Its narrow-spectrum activity and MIC values suggest that it could have potential for in vivo applications, but further studies would be needed to evaluate its efficacy in animal models of Campylobacter infection. The compound’s activity against foodborne pathogens makes it a candidate for further investigation in gastrointestinal infection models.
Enzyme Assay
The antimicrobial activity of Antimicrobial agent-14 can be assessed using standardized in vitro susceptibility testing methods, such as the broth microdilution assay as recommended by the Clinical and Laboratory Standards Institute (CLSI). In a typical assay, serial two-fold dilutions of the compound are prepared in cation-adjusted Mueller-Hinton broth in 96-well microtiter plates. Bacterial suspensions are adjusted to a 0.5 McFarland standard and added to each well. The plates are incubated at 37°C for 18-24 hours under microaerophilic conditions for Campylobacter species. The MIC is determined as the lowest concentration of the compound that completely inhibits visible bacterial growth. Quality control strains are included to validate the assay.
Cell Assay
The in vitro antibacterial activity of Antimicrobial agent-14 is assessed using Campylobacter coli ATCC33559 and Campylobacter jejuni 81-176 as test organisms. Bacterial cultures are grown on appropriate agar media under microaerophilic conditions at 37°C for 24-48 hours. Colonies are suspended in broth to achieve a standardized inoculum. The compound is dissolved in DMSO and diluted to working concentrations. The MIC is determined using the broth microdilution method in 96-well plates. The plates are incubated under microaerophilic conditions, and growth is assessed by measuring optical density at 600 nm or by visual inspection. The compound shows an MIC of 200 μM against C. coli ATCC33559.
Animal Protocol
No detailed in vivo animal model data for Antimicrobial agent-14 has been published in the available literature. The compound has not been evaluated in animal models of Campylobacter infection to assess its in vivo efficacy or pharmacokinetic properties. Future studies may involve the use of mouse or chicken models of Campylobacter colonization to evaluate the compound’s ability to reduce bacterial burden in the gastrointestinal tract. Such studies would be essential to confirm the compound’s in vivo antibacterial activity and to assess its potential for therapeutic development.
ADME/Pharmacokinetics
No detailed pharmacokinetic data for Antimicrobial agent-14 has been published in the available literature. The compound has a molecular weight of 277.75 g/mol and a LogP of 2.52, suggesting moderate lipophilicity. It is soluble in DMSO at 125 mg/mL (450.05 mM). The compound has a density of 1.5±0.1 g/cm³, a boiling point of 427.6±55.0 °C, and a flash point of 212.4±31.5 °C. Further studies would be needed to characterize the absorption, distribution, metabolism, and excretion (ADME) properties of Antimicrobial agent-14, including oral bioavailability, plasma protein binding, clearance, and half-life.
Toxicity/Toxicokinetics
No detailed toxicity data for Antimicrobial agent-14 has been published in the available literature. As a research compound with narrow-spectrum antibacterial activity, its safety profile has not been comprehensively evaluated. The compound is intended for research use only and is not for human or veterinary therapeutic use. The benzylthiophenesulfonamide class of compounds may have specific toxicity profiles that would need to be assessed in future studies. Comprehensive toxicology studies, including acute and chronic toxicity testing in multiple species, would be required to evaluate the safety profile of Antimicrobial agent-14 for potential therapeutic development.
References
[1]. Deblais L, et, al. Novel narrow spectrum benzyl thiophene sulfonamide derivatives to control Campylobacter. J Antibiot (Tokyo). 2019 Jul;72(7):555-565.
Additional Infomation
Antimicrobial agent-14 (5-chloro-N-(furan-2-ylmethyl)thiophene-2-sulfonamide) is a benzylthiophenesulfonamide analogue with antibacterial activity against Campylobacter species. The compound has an MIC of 200 μM against Campylobacter coli ATCC33559 and an MIC of >200 μM against Campylobacter jejuni 81-176. It is a research chemical used for the study of bacterial foodborne gastroenteritis. The compound has a molecular weight of 277.75 g/mol, a molecular formula of C9H8ClNO3S2, and a purity of ≥98%. It is typically stored as a powder at -20°C and is soluble in DMSO. The compound has been cited in a publication in the Journal of Antibiotics.
These protocols are for reference only. InvivoChem does not independently validate these methods.
Physicochemical Properties
Molecular Formula
C9H8CLNO3S2
Molecular Weight
277.75
Exact Mass
276.963
CAS #
380576-68-1
PubChem CID
2353996
Appearance
Typically exists as solid at room temperature
Density
1.5±0.1 g/cm3
Boiling Point
427.6±55.0 °C at 760 mmHg
Flash Point
212.4±31.5 °C
Vapour Pressure
0.0±1.0 mmHg at 25°C
Index of Refraction
1.609
LogP
2.52
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
5
Rotatable Bond Count
4
Heavy Atom Count
16
Complexity
330
Defined Atom Stereocenter Count
0
SMILES
C1(S(NCC2=CC=CO2)(=O)=O)SC(Cl)=CC=1
InChi Key
UOVJGVLNKRNDLY-UHFFFAOYSA-N
InChi Code
InChI=1S/C9H8ClNO3S2/c10-8-3-4-9(15-8)16(12,13)11-6-7-2-1-5-14-7/h1-5,11H,6H2
Chemical Name
5-chloro-N-(furan-2-ylmethyl)thiophene-2-sulfonamide
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)
DMSO : 125 mg/mL (450.05 mM)
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 3.6004 mL 18.0018 mL 36.0036 mL
5 mM 0.7201 mL 3.6004 mL 7.2007 mL
10 mM 0.3600 mL 1.8002 mL 3.6004 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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