3-((3-(Phenylsulfonamido)quinoxalin-2-yl)amino)benzoic acid
TL;DR: 3-((3-(Phenylsulfonamido)quinoxalin-2-yl)amino)benzoic acid (CAS 316361-50-9) is a chemical compound with molecular formula C21H16N4O4S and molecular weight 420.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[3-(benzenesulfonamido)quinoxalin-2-yl]amino]benzoic acid
Also Known As: AB00946654-05, 3-((3-(phenylsulfonamido)quinoxalin-2-yl)amino)benzoic acid, 3-[[3-(benzenesulfonamido)quinoxalin-2-yl]amino]benzoic Acid, F3225-0708, 3-({3-[(phenylsulfonyl)amino]quinoxalin-2-yl}amino)benzoic acid
| Molecular Formula | C21H16N4O4S |
|---|---|
| Molecular Weight | 420.09 g/mol |
| LogP | 3.8724 |
| Topological Polar Surface Area | 121.28 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 420.08923 |
| Heavy Atoms | 30 |
| Complexity | 1341.7388 |
Chemical Identifiers
| CAS Number | 316361-50-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)S(=O)(=O)NC2=NC3=CC=CC=C3N=C2NC4=CC=CC(=C4)C(=O)O |
Product Overview
3-((3-(Phenylsulfonamido)quinoxalin-2-yl)amino)benzoic acid (CAS 316361-50-9), with molecular formula C21H16N4O4S and molecular weight 420.09 g/mol. IUPAC: 3-[[3-(benzenesulfonamido)quinoxalin-2-yl]amino]benzoic acid.
Chemical Property Profile of 3-((3-(Phenylsulfonamido)quinoxalin-2-yl)amino)benzoic acid
Property Insights of 3-((3-(Phenylsulfonamido)quinoxalin-2-yl)amino)benzoic acid
The XLogP value of 3.8724 indicates that 3-((3-(Phenylsulfonamido)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-(Phenylsulfonamido)quinoxalin-2-yl)amino)benzoic acid. Following Lipinski's Rule of Five, 3-((3-(Phenylsulfonamido)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-(Phenylsulfonamido)quinoxalin-2-yl)amino)benzoic acid?
The CAS number of 3-((3-(Phenylsulfonamido)quinoxalin-2-yl)amino)benzoic acid is 316361-50-9.
What is the molecular formula of 3-((3-(Phenylsulfonamido)quinoxalin-2-yl)amino)benzoic acid?
The molecular formula of 3-((3-(Phenylsulfonamido)quinoxalin-2-yl)amino)benzoic acid is C21H16N4O4S.
What is the molecular weight of 3-((3-(Phenylsulfonamido)quinoxalin-2-yl)amino)benzoic acid?
The molecular weight of 3-((3-(Phenylsulfonamido)quinoxalin-2-yl)amino)benzoic acid is 420.09 g/mol.
Where can I buy 3-((3-(Phenylsulfonamido)quinoxalin-2-yl)amino)benzoic acid?
You can request a quote for 3-((3-(Phenylsulfonamido)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-(Phenylsulfonamido)quinoxalin-2-yl)amino)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-((3-(Phenylsulfonamido)quinoxalin-2-yl)amino)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.