2-Chloro-5-aminosulfonylbenzoic acid
TL;DR: 2-Chloro-5-aminosulfonylbenzoic acid (CAS 97-04-1) is a chemical compound with molecular formula C7H6ClNO4S and molecular weight 234.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-5-sulfamoylbenzoic acid
Also Known As: 2-chloro-5-sulfamoylbenzoic acid, Benzoic acid, 5-(aminosulfonyl)-2-chloro-, 2-Chloro-5-sulphamoylbenzoic acid, 3-CARBOXY-4-CHLOROBENZENESULFONAMIDE, 2-Chloro-5-sulfamoyl-benzoic acid
| Molecular Formula | C7H6ClNO4S |
|---|---|
| Molecular Weight | 234.97 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 106.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 234.97061 |
| Heavy Atoms | 14 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 97-04-1 |
|---|---|
| SMILES | C1=CC(=C(C=C1S(=O)(=O)N)C(=O)O)Cl |
| InChIKey | LWDSANAOYPHQAW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Chloro-5-aminosulfonylbenzoic acid (CAS 97-04-1), with molecular formula C7H6ClNO4S and molecular weight 234.97 g/mol. IUPAC: 2-chloro-5-sulfamoylbenzoic acid.
Chemical Property Profile of 2-Chloro-5-aminosulfonylbenzoic acid
Property Insights of 2-Chloro-5-aminosulfonylbenzoic acid
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloro-5-aminosulfonylbenzoic acid. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Chloro-5-aminosulfonylbenzoic acid. Following Lipinski's Rule of Five, 2-Chloro-5-aminosulfonylbenzoic acid 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 2-Chloro-5-aminosulfonylbenzoic acid?
The CAS number of 2-Chloro-5-aminosulfonylbenzoic acid is 97-04-1.
What is the molecular formula of 2-Chloro-5-aminosulfonylbenzoic acid?
The molecular formula of 2-Chloro-5-aminosulfonylbenzoic acid is C7H6ClNO4S.
What is the molecular weight of 2-Chloro-5-aminosulfonylbenzoic acid?
The molecular weight of 2-Chloro-5-aminosulfonylbenzoic acid is 234.97 g/mol.
Where can I buy 2-Chloro-5-aminosulfonylbenzoic acid?
You can request a quote for 2-Chloro-5-aminosulfonylbenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-5-aminosulfonylbenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-5-aminosulfonylbenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.