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2-[Benzyl(phenylsulfonyl)amino]benzoic acid
TL;DR: 2-[Benzyl(phenylsulfonyl)amino]benzoic acid (CAS 401602-98-0) is a chemical compound with molecular formula C20H17NO4S and molecular weight 367.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[benzenesulfonyl(benzyl)amino]benzoic acid
Also Known As: 2-[benzyl(phenylsulfonyl)amino]benzoic acid, 2-[benzenesulfonyl(benzyl)amino]benzoic acid, 2-Benzyl(phenylsulfonyl)aminobenzoic acid, 2-(N-benzylphenylsulfonamido)benzoic acid, 2-[benzyl(phenylsulfonyl)amino]benzoicacid
| Molecular Formula | C20H17NO4S |
|---|---|
| Molecular Weight | 367.09 g/mol |
| LogP | 3.7803 |
| Topological Polar Surface Area | 74.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 367.08783 |
| Heavy Atoms | 26 |
| Complexity | 1002.2508 |
Chemical Identifiers
| CAS Number | 401602-98-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN(C2=CC=CC=C2C(=O)O)S(=O)(=O)C3=CC=CC=C3 |
Product Overview
2-[Benzyl(phenylsulfonyl)amino]benzoic acid (CAS 401602-98-0), with molecular formula C20H17NO4S and molecular weight 367.09 g/mol. IUPAC: 2-[benzenesulfonyl(benzyl)amino]benzoic acid.
Chemical Property Profile of 2-[Benzyl(phenylsulfonyl)amino]benzoic acid
Property Insights of 2-[Benzyl(phenylsulfonyl)amino]benzoic acid
The XLogP value of 3.7803 indicates that 2-[Benzyl(phenylsulfonyl)amino]benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[Benzyl(phenylsulfonyl)amino]benzoic acid. Following Lipinski's Rule of Five, 2-[Benzyl(phenylsulfonyl)amino]benzoic acid has 1 hydrogen bond donor(s) and 3 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 2-[Benzyl(phenylsulfonyl)amino]benzoic acid?
The CAS number of 2-[Benzyl(phenylsulfonyl)amino]benzoic acid is 401602-98-0.
What is the molecular formula of 2-[Benzyl(phenylsulfonyl)amino]benzoic acid?
The molecular formula of 2-[Benzyl(phenylsulfonyl)amino]benzoic acid is C20H17NO4S.
What is the molecular weight of 2-[Benzyl(phenylsulfonyl)amino]benzoic acid?
The molecular weight of 2-[Benzyl(phenylsulfonyl)amino]benzoic acid is 367.09 g/mol.
Where can I buy 2-[Benzyl(phenylsulfonyl)amino]benzoic acid?
You can request a quote for 2-[Benzyl(phenylsulfonyl)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 2-[Benzyl(phenylsulfonyl)amino]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[Benzyl(phenylsulfonyl)amino]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.