![4-({[(3-Chloro-4-fluorophenyl)sulfonyl]amino}methyl)benzoic acid structure](/static/products/6906/690646-06-1.webp)
4-({[(3-Chloro-4-fluorophenyl)sulfonyl]amino}methyl)benzoic acid
TL;DR: 4-({[(3-Chloro-4-fluorophenyl)sulfonyl]amino}methyl)benzoic acid (CAS 690646-06-1) is a chemical compound with molecular formula C14H11ClFNO4S and molecular weight 343.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[(3-chloro-4-fluorophenyl)sulfonylamino]methyl]benzoic acid
Also Known As: 4-({[(3-chloro-4-fluorophenyl)sulfonyl]amino}methyl)benzoic acid, 4-((3-Chloro-4-fluorophenylsulfonamido)-methyl)benzoic acid, 4-(((3-chloro-4-fluorophenyl)sulfonamido)methyl)benzoic acid, 4-((3-chloro-4-fluorophenylsulfonamido)methyl)benzoic acid, 4-[[(3-chloro-4-fluorophenyl)sulfonylamino]methyl]benzoic acid
| Molecular Formula | C14H11ClFNO4S |
|---|---|
| Molecular Weight | 343.01 g/mol |
| LogP | 2.6558 |
| Topological Polar Surface Area | 83.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 343.00815 |
| Heavy Atoms | 22 |
| Complexity | 806.0926 |
Chemical Identifiers
| CAS Number | 690646-06-1 |
|---|---|
| SMILES | C1=CC(=CC=C1CNS(=O)(=O)C2=CC(=C(C=C2)F)Cl)C(=O)O |
Product Overview
4-({[(3-Chloro-4-fluorophenyl)sulfonyl]amino}methyl)benzoic acid (CAS 690646-06-1), with molecular formula C14H11ClFNO4S and molecular weight 343.01 g/mol. IUPAC: 4-[[(3-chloro-4-fluorophenyl)sulfonylamino]methyl]benzoic acid.
Chemical Property Profile of 4-({[(3-Chloro-4-fluorophenyl)sulfonyl]amino}methyl)benzoic acid
Property Insights of 4-({[(3-Chloro-4-fluorophenyl)sulfonyl]amino}methyl)benzoic acid
The XLogP value of 2.6558 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-({[(3-Chloro-4-fluorophenyl)sulfonyl]amino}methyl)benzoic acid. The TPSA of 83.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-({[(3-Chloro-4-fluorophenyl)sulfonyl]amino}methyl)benzoic acid. Following Lipinski's Rule of Five, 4-({[(3-Chloro-4-fluorophenyl)sulfonyl]amino}methyl)benzoic 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 4-({[(3-Chloro-4-fluorophenyl)sulfonyl]amino}methyl)benzoic acid?
The CAS number of 4-({[(3-Chloro-4-fluorophenyl)sulfonyl]amino}methyl)benzoic acid is 690646-06-1.
What is the molecular formula of 4-({[(3-Chloro-4-fluorophenyl)sulfonyl]amino}methyl)benzoic acid?
The molecular formula of 4-({[(3-Chloro-4-fluorophenyl)sulfonyl]amino}methyl)benzoic acid is C14H11ClFNO4S.
What is the molecular weight of 4-({[(3-Chloro-4-fluorophenyl)sulfonyl]amino}methyl)benzoic acid?
The molecular weight of 4-({[(3-Chloro-4-fluorophenyl)sulfonyl]amino}methyl)benzoic acid is 343.01 g/mol.
Where can I buy 4-({[(3-Chloro-4-fluorophenyl)sulfonyl]amino}methyl)benzoic acid?
You can request a quote for 4-({[(3-Chloro-4-fluorophenyl)sulfonyl]amino}methyl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-({[(3-Chloro-4-fluorophenyl)sulfonyl]amino}methyl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-({[(3-Chloro-4-fluorophenyl)sulfonyl]amino}methyl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.