![4-[Benzyl(methylsulfonyl)amino]benzoic acid structure](/static/products/3333/333357-39-4.webp)
4-[Benzyl(methylsulfonyl)amino]benzoic acid
TL;DR: 4-[Benzyl(methylsulfonyl)amino]benzoic acid (CAS 333357-39-4) 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.
4-[benzyl(methylsulfonyl)amino]benzoic acid
Also Known As: 4-[benzyl(methylsulfonyl)amino]benzoic acid, 4-(N-benzylmethylsulfonamido)benzoic acid, 4-[benzyl(methylsulfonyl)amino]benzoicacid, 4-(benzyl-methylsulfonyl-amino)benzoic Acid, 4-(N-BENZYLMETHANESULFONAMIDO)BENZOIC ACID
| Molecular Formula | C15H15NO4S |
|---|---|
| Molecular Weight | 305.07 g/mol |
| LogP | 2.351 |
| Topological Polar Surface Area | 74.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 305.07217 |
| Heavy Atoms | 21 |
| Complexity | 724.02875 |
Chemical Identifiers
| CAS Number | 333357-39-4 |
|---|---|
| SMILES | CS(=O)(=O)N(CC1=CC=CC=C1)C2=CC=C(C=C2)C(=O)O |
Product Overview
4-[Benzyl(methylsulfonyl)amino]benzoic acid (CAS 333357-39-4), with molecular formula C15H15NO4S and molecular weight 305.07 g/mol. IUPAC: 4-[benzyl(methylsulfonyl)amino]benzoic acid.
Chemical Property Profile of 4-[Benzyl(methylsulfonyl)amino]benzoic acid
Property Insights of 4-[Benzyl(methylsulfonyl)amino]benzoic acid
The XLogP value of 2.351 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[Benzyl(methylsulfonyl)amino]benzoic acid. The TPSA of 74.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[Benzyl(methylsulfonyl)amino]benzoic acid. Following Lipinski's Rule of Five, 4-[Benzyl(methylsulfonyl)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 4-[Benzyl(methylsulfonyl)amino]benzoic acid?
The CAS number of 4-[Benzyl(methylsulfonyl)amino]benzoic acid is 333357-39-4.
What is the molecular formula of 4-[Benzyl(methylsulfonyl)amino]benzoic acid?
The molecular formula of 4-[Benzyl(methylsulfonyl)amino]benzoic acid is C15H15NO4S.
What is the molecular weight of 4-[Benzyl(methylsulfonyl)amino]benzoic acid?
The molecular weight of 4-[Benzyl(methylsulfonyl)amino]benzoic acid is 305.07 g/mol.
Where can I buy 4-[Benzyl(methylsulfonyl)amino]benzoic acid?
You can request a quote for 4-[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 4-[Benzyl(methylsulfonyl)amino]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[Benzyl(methylsulfonyl)amino]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.