![4-{[(4-Bromo-3-methoxyphenyl)sulfonyl]amino}benzoic acid structure](/static/products/7945/794548-52-0.webp)
4-{[(4-Bromo-3-methoxyphenyl)sulfonyl]amino}benzoic acid
TL;DR: 4-{[(4-Bromo-3-methoxyphenyl)sulfonyl]amino}benzoic acid (CAS 794548-52-0) is a chemical compound with molecular formula C14H12BrNO5S and molecular weight 384.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-bromo-3-methoxyphenyl)sulfonylamino]benzoic acid
Also Known As: 4-{[(4-bromo-3-methoxyphenyl)sulfonyl]amino}benzoic acid, 4-[(4-bromo-3-methoxyphenyl)sulfonylamino]benzoic acid, AP-263/43241418
| Molecular Formula | C14H12BrNO5S |
|---|---|
| Molecular Weight | 384.96 g/mol |
| LogP | 2.9567 |
| Topological Polar Surface Area | 92.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 384.96198 |
| Heavy Atoms | 22 |
| Complexity | 802.483 |
Chemical Identifiers
| CAS Number | 794548-52-0 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)O)Br |
Product Overview
4-{[(4-Bromo-3-methoxyphenyl)sulfonyl]amino}benzoic acid (CAS 794548-52-0), with molecular formula C14H12BrNO5S and molecular weight 384.96 g/mol. IUPAC: 4-[(4-bromo-3-methoxyphenyl)sulfonylamino]benzoic acid.
Chemical Property Profile of 4-{[(4-Bromo-3-methoxyphenyl)sulfonyl]amino}benzoic acid
Property Insights of 4-{[(4-Bromo-3-methoxyphenyl)sulfonyl]amino}benzoic acid
The XLogP value of 2.9567 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-{[(4-Bromo-3-methoxyphenyl)sulfonyl]amino}benzoic acid. The TPSA of 92.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{[(4-Bromo-3-methoxyphenyl)sulfonyl]amino}benzoic acid. Following Lipinski's Rule of Five, 4-{[(4-Bromo-3-methoxyphenyl)sulfonyl]amino}benzoic acid has 2 hydrogen bond donor(s) and 4 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-{[(4-Bromo-3-methoxyphenyl)sulfonyl]amino}benzoic acid?
The CAS number of 4-{[(4-Bromo-3-methoxyphenyl)sulfonyl]amino}benzoic acid is 794548-52-0.
What is the molecular formula of 4-{[(4-Bromo-3-methoxyphenyl)sulfonyl]amino}benzoic acid?
The molecular formula of 4-{[(4-Bromo-3-methoxyphenyl)sulfonyl]amino}benzoic acid is C14H12BrNO5S.
What is the molecular weight of 4-{[(4-Bromo-3-methoxyphenyl)sulfonyl]amino}benzoic acid?
The molecular weight of 4-{[(4-Bromo-3-methoxyphenyl)sulfonyl]amino}benzoic acid is 384.96 g/mol.
Where can I buy 4-{[(4-Bromo-3-methoxyphenyl)sulfonyl]amino}benzoic acid?
You can request a quote for 4-{[(4-Bromo-3-methoxyphenyl)sulfonyl]amino}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-{[(4-Bromo-3-methoxyphenyl)sulfonyl]amino}benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-{[(4-Bromo-3-methoxyphenyl)sulfonyl]amino}benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.