![1-{[(3-Chloro-4-fluorophenyl)sulfonyl]amino}cyclohexanecarboxylic acid structure](/static/products/6906/690646-08-3.webp)
1-{[(3-Chloro-4-fluorophenyl)sulfonyl]amino}cyclohexanecarboxylic acid
TL;DR: 1-{[(3-Chloro-4-fluorophenyl)sulfonyl]amino}cyclohexanecarboxylic acid (CAS 690646-08-3) is a chemical compound with molecular formula C13H15ClFNO4S and molecular weight 335.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(3-chloro-4-fluorophenyl)sulfonylamino]cyclohexane-1-carboxylic acid
Also Known As: CBKinase1_007690, CBKinase1_020090, 1-{[(3-chloro-4-fluorophenyl)sulfonyl]amino}cyclohexanecarboxylic acid, 1-((3-chloro-4-fluorophenyl)sulfonamido)cyclohexane-1-carboxylic acid, 1-[(3-chloro-4-fluorophenyl)sulfonylamino]cyclohexane-1-carboxylic acid
| Molecular Formula | C13H15ClFNO4S |
|---|---|
| Molecular Weight | 335.04 g/mol |
| LogP | 2.5449 |
| Topological Polar Surface Area | 83.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 335.03943 |
| Heavy Atoms | 21 |
| Complexity | 656.13513 |
Chemical Identifiers
| CAS Number | 690646-08-3 |
|---|---|
| SMILES | C1CCC(CC1)(C(=O)O)NS(=O)(=O)C2=CC(=C(C=C2)F)Cl |
Product Overview
1-{[(3-Chloro-4-fluorophenyl)sulfonyl]amino}cyclohexanecarboxylic acid (CAS 690646-08-3), with molecular formula C13H15ClFNO4S and molecular weight 335.04 g/mol. IUPAC: 1-[(3-chloro-4-fluorophenyl)sulfonylamino]cyclohexane-1-carboxylic acid.
Chemical Property Profile of 1-{[(3-Chloro-4-fluorophenyl)sulfonyl]amino}cyclohexanecarboxylic acid
Property Insights of 1-{[(3-Chloro-4-fluorophenyl)sulfonyl]amino}cyclohexanecarboxylic acid
The XLogP value of 2.5449 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-{[(3-Chloro-4-fluorophenyl)sulfonyl]amino}cyclohexanecarboxylic acid. The TPSA of 83.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-{[(3-Chloro-4-fluorophenyl)sulfonyl]amino}cyclohexanecarboxylic acid. Following Lipinski's Rule of Five, 1-{[(3-Chloro-4-fluorophenyl)sulfonyl]amino}cyclohexanecarboxylic acid has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-{[(3-Chloro-4-fluorophenyl)sulfonyl]amino}cyclohexanecarboxylic acid?
The CAS number of 1-{[(3-Chloro-4-fluorophenyl)sulfonyl]amino}cyclohexanecarboxylic acid is 690646-08-3.
What is the molecular formula of 1-{[(3-Chloro-4-fluorophenyl)sulfonyl]amino}cyclohexanecarboxylic acid?
The molecular formula of 1-{[(3-Chloro-4-fluorophenyl)sulfonyl]amino}cyclohexanecarboxylic acid is C13H15ClFNO4S.
What is the molecular weight of 1-{[(3-Chloro-4-fluorophenyl)sulfonyl]amino}cyclohexanecarboxylic acid?
The molecular weight of 1-{[(3-Chloro-4-fluorophenyl)sulfonyl]amino}cyclohexanecarboxylic acid is 335.04 g/mol.
Where can I buy 1-{[(3-Chloro-4-fluorophenyl)sulfonyl]amino}cyclohexanecarboxylic acid?
You can request a quote for 1-{[(3-Chloro-4-fluorophenyl)sulfonyl]amino}cyclohexanecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-{[(3-Chloro-4-fluorophenyl)sulfonyl]amino}cyclohexanecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-{[(3-Chloro-4-fluorophenyl)sulfonyl]amino}cyclohexanecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.