4-({2-[(Carboxymethyl)sulfinyl]acetyl}amino)benzenecarboxylic acid
TL;DR: 4-({2-[(Carboxymethyl)sulfinyl]acetyl}amino)benzenecarboxylic acid (CAS 344264-65-9) is a chemical compound with molecular formula C11H11NO6S and molecular weight 285.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[2-(carboxymethylsulfinyl)acetyl]amino]benzoic acid
Also Known As: 4-[[2-(carboxymethylsulfinyl)acetyl]amino]benzoic Acid, 4-[2-(carboxymethanesulfinyl)acetamido]benzoic acid, 4-({2-[(carboxymethyl)sulfinyl]acetyl}amino)benzenecarboxylic acid, 7H-321S, 4-[2-(carboxymethanesulfinyl)acetamido]benzoicacid
| Molecular Formula | C11H11NO6S |
|---|---|
| Molecular Weight | 285.03 g/mol |
| LogP | 0.1566 |
| Topological Polar Surface Area | 120.77 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 285.0307 |
| Heavy Atoms | 19 |
| Complexity | 524.4919 |
Chemical Identifiers
| CAS Number | 344264-65-9 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)O)NC(=O)CS(=O)CC(=O)O |
Product Overview
4-({2-[(Carboxymethyl)sulfinyl]acetyl}amino)benzenecarboxylic acid (CAS 344264-65-9), with molecular formula C11H11NO6S and molecular weight 285.03 g/mol. IUPAC: 4-[[2-(carboxymethylsulfinyl)acetyl]amino]benzoic acid.
Chemical Property Profile of 4-({2-[(Carboxymethyl)sulfinyl]acetyl}amino)benzenecarboxylic acid
Property Insights of 4-({2-[(Carboxymethyl)sulfinyl]acetyl}amino)benzenecarboxylic acid
The XLogP value of 0.1566 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-({2-[(Carboxymethyl)sulfinyl]acetyl}amino)benzenecarboxylic acid. The TPSA of 120.77 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-({2-[(Carboxymethyl)sulfinyl]acetyl}amino)benzenecarboxylic acid. Following Lipinski's Rule of Five, 4-({2-[(Carboxymethyl)sulfinyl]acetyl}amino)benzenecarboxylic acid has 3 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-({2-[(Carboxymethyl)sulfinyl]acetyl}amino)benzenecarboxylic acid?
The CAS number of 4-({2-[(Carboxymethyl)sulfinyl]acetyl}amino)benzenecarboxylic acid is 344264-65-9.
What is the molecular formula of 4-({2-[(Carboxymethyl)sulfinyl]acetyl}amino)benzenecarboxylic acid?
The molecular formula of 4-({2-[(Carboxymethyl)sulfinyl]acetyl}amino)benzenecarboxylic acid is C11H11NO6S.
What is the molecular weight of 4-({2-[(Carboxymethyl)sulfinyl]acetyl}amino)benzenecarboxylic acid?
The molecular weight of 4-({2-[(Carboxymethyl)sulfinyl]acetyl}amino)benzenecarboxylic acid is 285.03 g/mol.
Where can I buy 4-({2-[(Carboxymethyl)sulfinyl]acetyl}amino)benzenecarboxylic acid?
You can request a quote for 4-({2-[(Carboxymethyl)sulfinyl]acetyl}amino)benzenecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-({2-[(Carboxymethyl)sulfinyl]acetyl}amino)benzenecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-({2-[(Carboxymethyl)sulfinyl]acetyl}amino)benzenecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.