3-Amino-4-(2-carboxyphenylsulfonyl)benzoic acid
TL;DR: 3-Amino-4-(2-carboxyphenylsulfonyl)benzoic acid (CAS 656814-68-5) is a chemical compound with molecular formula C14H11NO6S and molecular weight 321.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-4-(2-carboxyphenyl)sulfonylbenzoic acid
Also Known As: 3-AMINO-4-(2-CARBOXYPHENYLSULFONYL)BENZOIC ACID, 3-amino-4-(2-carboxyphenyl)sulfonylbenzoic acid, 3-amino-4-(2-carboxyphenyl)sulfonyl-benzoic Acid
| Molecular Formula | C14H11NO6S |
|---|---|
| Molecular Weight | 321.03 g/mol |
| LogP | 1.498 |
| Topological Polar Surface Area | 134.76 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 321.0307 |
| Heavy Atoms | 22 |
| Complexity | 872.65186 |
Chemical Identifiers
| CAS Number | 656814-68-5 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)O)S(=O)(=O)C2=C(C=C(C=C2)C(=O)O)N |
Product Overview
3-Amino-4-(2-carboxyphenylsulfonyl)benzoic acid (CAS 656814-68-5), with molecular formula C14H11NO6S and molecular weight 321.03 g/mol. IUPAC: 3-amino-4-(2-carboxyphenyl)sulfonylbenzoic acid.
Chemical Property Profile of 3-Amino-4-(2-carboxyphenylsulfonyl)benzoic acid
Property Insights of 3-Amino-4-(2-carboxyphenylsulfonyl)benzoic acid
The XLogP value of 1.498 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Amino-4-(2-carboxyphenylsulfonyl)benzoic acid. The TPSA of 134.76 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Amino-4-(2-carboxyphenylsulfonyl)benzoic acid. Following Lipinski's Rule of Five, 3-Amino-4-(2-carboxyphenylsulfonyl)benzoic acid has 3 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 3-Amino-4-(2-carboxyphenylsulfonyl)benzoic acid?
The CAS number of 3-Amino-4-(2-carboxyphenylsulfonyl)benzoic acid is 656814-68-5.
What is the molecular formula of 3-Amino-4-(2-carboxyphenylsulfonyl)benzoic acid?
The molecular formula of 3-Amino-4-(2-carboxyphenylsulfonyl)benzoic acid is C14H11NO6S.
What is the molecular weight of 3-Amino-4-(2-carboxyphenylsulfonyl)benzoic acid?
The molecular weight of 3-Amino-4-(2-carboxyphenylsulfonyl)benzoic acid is 321.03 g/mol.
Where can I buy 3-Amino-4-(2-carboxyphenylsulfonyl)benzoic acid?
You can request a quote for 3-Amino-4-(2-carboxyphenylsulfonyl)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-Amino-4-(2-carboxyphenylsulfonyl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Amino-4-(2-carboxyphenylsulfonyl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.