4-Bromo-3-sulfamoylbenzoic acid
TL;DR: 4-Bromo-3-sulfamoylbenzoic acid (CAS 59815-19-9) is a chemical compound with molecular formula C7H6BrNO4S and molecular weight 278.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-3-sulfamoylbenzoic acid
Also Known As: 4-bromo-3-sulfamoylbenzoic acid, 3-(Aminosulfonyl)-4-bromobenzoic acid, 4-Bromo-3-sulfamoyl-benzoic acid, 4-bromo-3-sulfamoylbenzoicacid, 4-Bromo-3-sulfamoyl-benzoicacid
| Molecular Formula | C7H6BrNO4S |
|---|---|
| Molecular Weight | 278.92 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 106.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 278.9201 |
| Heavy Atoms | 14 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 59815-19-9 |
|---|---|
| SMILES | C1=CC(=C(C=C1C(=O)O)S(=O)(=O)N)Br |
| InChIKey | XDNAVLYDHZTCRB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Bromo-3-sulfamoylbenzoic acid (CAS 59815-19-9), with molecular formula C7H6BrNO4S and molecular weight 278.92 g/mol. IUPAC: 4-bromo-3-sulfamoylbenzoic acid.
Chemical Property Profile of 4-Bromo-3-sulfamoylbenzoic acid
Property Insights of 4-Bromo-3-sulfamoylbenzoic acid
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Bromo-3-sulfamoylbenzoic acid. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Bromo-3-sulfamoylbenzoic acid. Following Lipinski's Rule of Five, 4-Bromo-3-sulfamoylbenzoic 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 4-Bromo-3-sulfamoylbenzoic acid?
The CAS number of 4-Bromo-3-sulfamoylbenzoic acid is 59815-19-9.
What is the molecular formula of 4-Bromo-3-sulfamoylbenzoic acid?
The molecular formula of 4-Bromo-3-sulfamoylbenzoic acid is C7H6BrNO4S.
What is the molecular weight of 4-Bromo-3-sulfamoylbenzoic acid?
The molecular weight of 4-Bromo-3-sulfamoylbenzoic acid is 278.92 g/mol.
Where can I buy 4-Bromo-3-sulfamoylbenzoic acid?
You can request a quote for 4-Bromo-3-sulfamoylbenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromo-3-sulfamoylbenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromo-3-sulfamoylbenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.