![Benzoicacid, 3-[[(3-chloro-4-fluorophenyl)sulfonyl]amino]- structure](/static/products/6120/612043-03-5.webp)
Benzoicacid, 3-[[(3-chloro-4-fluorophenyl)sulfonyl]amino]-
TL;DR: Benzoicacid, 3-[[(3-chloro-4-fluorophenyl)sulfonyl]amino]- (CAS 612043-03-5) is a chemical compound with molecular formula C13H9ClFNO4S and molecular weight 328.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(3-chloro-4-fluorophenyl)sulfonylamino]benzoic acid
Also Known As: Benzoicacid, 3-[[(3-chloro-4-fluorophenyl)sulfonyl]amino]-, 3-[(3-chloro-4-fluorophenyl)sulfonylamino]benzoic acid, 3-(3-Chloro-4-fluorobenzene-1-sulfonamido)benzoic acid, 3-[(3-chloro-4-fluoro-phenyl)sulfonylamino]benzoic Acid, Benzoicacid,3-[[(3-chloro-4-fluorophenyl)sulfonyl]amino]-
| Molecular Formula | C13H9ClFNO4S |
|---|---|
| Molecular Weight | 328.99 g/mol |
| LogP | 2.9781 |
| Topological Polar Surface Area | 83.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 328.9925 |
| Heavy Atoms | 21 |
| Complexity | 807.5686 |
Chemical Identifiers
| CAS Number | 612043-03-5 |
|---|---|
| SMILES | C1=CC(=CC(=C1)NS(=O)(=O)C2=CC(=C(C=C2)F)Cl)C(=O)O |
Product Overview
Benzoicacid, 3-[[(3-chloro-4-fluorophenyl)sulfonyl]amino]- (CAS 612043-03-5), with molecular formula C13H9ClFNO4S and molecular weight 328.99 g/mol. IUPAC: 3-[(3-chloro-4-fluorophenyl)sulfonylamino]benzoic acid.
Chemical Property Profile of Benzoicacid, 3-[[(3-chloro-4-fluorophenyl)sulfonyl]amino]-
Property Insights of Benzoicacid, 3-[[(3-chloro-4-fluorophenyl)sulfonyl]amino]-
The XLogP value of 2.9781 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoicacid, 3-[[(3-chloro-4-fluorophenyl)sulfonyl]amino]-. The TPSA of 83.47 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoicacid, 3-[[(3-chloro-4-fluorophenyl)sulfonyl]amino]-. Following Lipinski's Rule of Five, Benzoicacid, 3-[[(3-chloro-4-fluorophenyl)sulfonyl]amino]- 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 Benzoicacid, 3-[[(3-chloro-4-fluorophenyl)sulfonyl]amino]-?
The CAS number of Benzoicacid, 3-[[(3-chloro-4-fluorophenyl)sulfonyl]amino]- is 612043-03-5.
What is the molecular formula of Benzoicacid, 3-[[(3-chloro-4-fluorophenyl)sulfonyl]amino]-?
The molecular formula of Benzoicacid, 3-[[(3-chloro-4-fluorophenyl)sulfonyl]amino]- is C13H9ClFNO4S.
What is the molecular weight of Benzoicacid, 3-[[(3-chloro-4-fluorophenyl)sulfonyl]amino]-?
The molecular weight of Benzoicacid, 3-[[(3-chloro-4-fluorophenyl)sulfonyl]amino]- is 328.99 g/mol.
Where can I buy Benzoicacid, 3-[[(3-chloro-4-fluorophenyl)sulfonyl]amino]-?
You can request a quote for Benzoicacid, 3-[[(3-chloro-4-fluorophenyl)sulfonyl]amino]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoicacid, 3-[[(3-chloro-4-fluorophenyl)sulfonyl]amino]-?
Yes, KEHONG BIO provides custom synthesis services for Benzoicacid, 3-[[(3-chloro-4-fluorophenyl)sulfonyl]amino]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.