![Benzoic acid, 2-chloro-5-[(phenylamino)sulfonyl]- structure](/static/products/6818/68189-34-4.webp)
Benzoic acid, 2-chloro-5-[(phenylamino)sulfonyl]-
TL;DR: Benzoic acid, 2-chloro-5-[(phenylamino)sulfonyl]- (CAS 68189-34-4) is a chemical compound with molecular formula C13H10ClNO4S and molecular weight 311.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-5-(phenylsulfamoyl)benzoic acid
Also Known As: 2-chloro-5-(phenylsulfamoyl)benzoic acid, 2-chloro-5-[(phenylamino)sulphonyl]benzoic acid, Benzoic acid, 2-chloro-5-[(phenylamino)sulfonyl]-, 2-Chloro-5-phenylsulfamoylbenzoic acid, 2-chloro-5-[(phenylamino)sulfonyl]benzoic acid
| Molecular Formula | C13H10ClNO4S |
|---|---|
| Molecular Weight | 311.00 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 91.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 311.0019 |
| Heavy Atoms | 20 |
| Complexity | 442.0 |
Chemical Identifiers
| CAS Number | 68189-34-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)O |
| InChIKey | BYKANEVMPOZIQF-UHFFFAOYSA-N |
Product Overview
Benzoic acid, 2-chloro-5-[(phenylamino)sulfonyl]- (CAS 68189-34-4), with molecular formula C13H10ClNO4S and molecular weight 311.00 g/mol. IUPAC: 2-chloro-5-(phenylsulfamoyl)benzoic acid.
Chemical Property Profile of Benzoic acid, 2-chloro-5-[(phenylamino)sulfonyl]-
Property Insights of Benzoic acid, 2-chloro-5-[(phenylamino)sulfonyl]-
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 2-chloro-5-[(phenylamino)sulfonyl]-. The TPSA of 91.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 2-chloro-5-[(phenylamino)sulfonyl]-. Following Lipinski's Rule of Five, Benzoic acid, 2-chloro-5-[(phenylamino)sulfonyl]- has 2 hydrogen bond donor(s) and 5 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 Benzoic acid, 2-chloro-5-[(phenylamino)sulfonyl]-?
The CAS number of Benzoic acid, 2-chloro-5-[(phenylamino)sulfonyl]- is 68189-34-4.
What is the molecular formula of Benzoic acid, 2-chloro-5-[(phenylamino)sulfonyl]-?
The molecular formula of Benzoic acid, 2-chloro-5-[(phenylamino)sulfonyl]- is C13H10ClNO4S.
What is the molecular weight of Benzoic acid, 2-chloro-5-[(phenylamino)sulfonyl]-?
The molecular weight of Benzoic acid, 2-chloro-5-[(phenylamino)sulfonyl]- is 311.00 g/mol.
Where can I buy Benzoic acid, 2-chloro-5-[(phenylamino)sulfonyl]-?
You can request a quote for Benzoic acid, 2-chloro-5-[(phenylamino)sulfonyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 2-chloro-5-[(phenylamino)sulfonyl]-?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 2-chloro-5-[(phenylamino)sulfonyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.