![3-[(3-{[(3-Chlorophenyl)sulfonyl]amino}quinoxalin-2-yl)amino]benzoic acid structure](/static/products/714/714939-73-8.png)
3-[(3-{[(3-Chlorophenyl)sulfonyl]amino}quinoxalin-2-yl)amino]benzoic acid
TL;DR: 3-[(3-{[(3-Chlorophenyl)sulfonyl]amino}quinoxalin-2-yl)amino]benzoic acid (CAS 714939-73-8) is a chemical compound with molecular formula C21H15ClN4O4S and molecular weight 454.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[3-[(3-chlorophenyl)sulfonylamino]quinoxalin-2-yl]amino]benzoic acid
Also Known As: 3-[(3-{[(3-chlorophenyl)sulfonyl]amino}quinoxalin-2-yl)amino]benzoic acid, 3-[[3-[(3-chlorophenyl)sulfonylamino]quinoxalin-2-yl]amino]benzoic Acid, 3-((3-(3-chlorophenylsulfonamido)quinoxalin-2-yl)amino)benzoic acid, 3-{[(3Z)-3-{[(3-chlorophenyl)sulfonyl]imino}-3,4-dihydroquinoxalin-2-yl]amino}benzoic acid
| Molecular Formula | C21H15ClN4O4S |
|---|---|
| Molecular Weight | 454.05 g/mol |
| LogP | 4.5258 |
| Topological Polar Surface Area | 121.28 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 454.05026 |
| Heavy Atoms | 31 |
| Complexity | 1409.6815 |
Chemical Identifiers
| CAS Number | 714939-73-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(C(=N2)NS(=O)(=O)C3=CC(=CC=C3)Cl)NC4=CC=CC(=C4)C(=O)O |
Product Overview
3-[(3-{[(3-Chlorophenyl)sulfonyl]amino}quinoxalin-2-yl)amino]benzoic acid (CAS 714939-73-8), with molecular formula C21H15ClN4O4S and molecular weight 454.05 g/mol. IUPAC: 3-[[3-[(3-chlorophenyl)sulfonylamino]quinoxalin-2-yl]amino]benzoic acid.
Chemical Property Profile of 3-[(3-{[(3-Chlorophenyl)sulfonyl]amino}quinoxalin-2-yl)amino]benzoic acid
Property Insights of 3-[(3-{[(3-Chlorophenyl)sulfonyl]amino}quinoxalin-2-yl)amino]benzoic acid
The XLogP value of 4.5258 indicates that 3-[(3-{[(3-Chlorophenyl)sulfonyl]amino}quinoxalin-2-yl)amino]benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 121.28 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(3-{[(3-Chlorophenyl)sulfonyl]amino}quinoxalin-2-yl)amino]benzoic acid. Following Lipinski's Rule of Five, 3-[(3-{[(3-Chlorophenyl)sulfonyl]amino}quinoxalin-2-yl)amino]benzoic acid has 3 hydrogen bond donor(s) and 6 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 3-[(3-{[(3-Chlorophenyl)sulfonyl]amino}quinoxalin-2-yl)amino]benzoic acid?
The CAS number of 3-[(3-{[(3-Chlorophenyl)sulfonyl]amino}quinoxalin-2-yl)amino]benzoic acid is 714939-73-8.
What is the molecular formula of 3-[(3-{[(3-Chlorophenyl)sulfonyl]amino}quinoxalin-2-yl)amino]benzoic acid?
The molecular formula of 3-[(3-{[(3-Chlorophenyl)sulfonyl]amino}quinoxalin-2-yl)amino]benzoic acid is C21H15ClN4O4S.
What is the molecular weight of 3-[(3-{[(3-Chlorophenyl)sulfonyl]amino}quinoxalin-2-yl)amino]benzoic acid?
The molecular weight of 3-[(3-{[(3-Chlorophenyl)sulfonyl]amino}quinoxalin-2-yl)amino]benzoic acid is 454.05 g/mol.
Where can I buy 3-[(3-{[(3-Chlorophenyl)sulfonyl]amino}quinoxalin-2-yl)amino]benzoic acid?
You can request a quote for 3-[(3-{[(3-Chlorophenyl)sulfonyl]amino}quinoxalin-2-yl)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 3-[(3-{[(3-Chlorophenyl)sulfonyl]amino}quinoxalin-2-yl)amino]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[(3-{[(3-Chlorophenyl)sulfonyl]amino}quinoxalin-2-yl)amino]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.