![2-[Benzyl(methylsulfonyl)amino]benzoic acid structure](/static/products/3333/333357-38-3.webp)
2-[Benzyl(methylsulfonyl)amino]benzoic acid
TL;DR: 2-[Benzyl(methylsulfonyl)amino]benzoic acid (CAS 333357-38-3) is a chemical compound with molecular formula C15H15NO4S and molecular weight 305.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[benzyl(methylsulfonyl)amino]benzoic acid
Also Known As: 2-[benzyl(methylsulfonyl)amino]benzoic acid, 2-(N-benzylmethanesulfonamido)benzoic acid, 2-Benzyl(methylsulfonyl)aminobenzoic acid, 2-(N-benzylmethylsulfonamido)benzoic acid, BAS 00794342
| Molecular Formula | C15H15NO4S |
|---|---|
| Molecular Weight | 305.07 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 83.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 305.07217 |
| Heavy Atoms | 21 |
| Complexity | 451.0 |
Chemical Identifiers
| CAS Number | 333357-38-3 |
|---|---|
| SMILES | CS(=O)(=O)N(CC1=CC=CC=C1)C2=CC=CC=C2C(=O)O |
| InChIKey | VHAXDHPAMFQVPQ-UHFFFAOYSA-N |
Product Overview
2-[Benzyl(methylsulfonyl)amino]benzoic acid (CAS 333357-38-3), with molecular formula C15H15NO4S and molecular weight 305.07 g/mol. IUPAC: 2-[benzyl(methylsulfonyl)amino]benzoic acid.
Chemical Property Profile of 2-[Benzyl(methylsulfonyl)amino]benzoic acid
Property Insights of 2-[Benzyl(methylsulfonyl)amino]benzoic acid
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[Benzyl(methylsulfonyl)amino]benzoic acid. The TPSA of 83.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[Benzyl(methylsulfonyl)amino]benzoic acid. Following Lipinski's Rule of Five, 2-[Benzyl(methylsulfonyl)amino]benzoic acid has 1 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 2-[Benzyl(methylsulfonyl)amino]benzoic acid?
The CAS number of 2-[Benzyl(methylsulfonyl)amino]benzoic acid is 333357-38-3.
What is the molecular formula of 2-[Benzyl(methylsulfonyl)amino]benzoic acid?
The molecular formula of 2-[Benzyl(methylsulfonyl)amino]benzoic acid is C15H15NO4S.
What is the molecular weight of 2-[Benzyl(methylsulfonyl)amino]benzoic acid?
The molecular weight of 2-[Benzyl(methylsulfonyl)amino]benzoic acid is 305.07 g/mol.
Where can I buy 2-[Benzyl(methylsulfonyl)amino]benzoic acid?
You can request a quote for 2-[Benzyl(methylsulfonyl)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(methylsulfonyl)amino]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[Benzyl(methylsulfonyl)amino]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.