![4-[(Mesitylsulfonyl)amino]benzoic acid structure](/static/products/1664/166405-50-1.webp)
4-[(Mesitylsulfonyl)amino]benzoic acid
TL;DR: 4-[(Mesitylsulfonyl)amino]benzoic acid (CAS 166405-50-1) is a chemical compound with molecular formula C16H17NO4S and molecular weight 319.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(2,4,6-trimethylphenyl)sulfonylamino]benzoic acid
Also Known As: 4-[(mesitylsulfonyl)amino]benzoic acid, Benzoic acid, 4-[[(2,4,6-trimethylphenyl)sulfonyl]amino]-, 4-[(2,4,6-trimethylphenyl)sulfonylamino]benzoic acid, AP-263/09021037, AB00075164-01
| Molecular Formula | C16H17NO4S |
|---|---|
| Molecular Weight | 319.09 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 91.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 319.08783 |
| Heavy Atoms | 22 |
| Complexity | 479.0 |
Chemical Identifiers
| CAS Number | 166405-50-1 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C)S(=O)(=O)NC2=CC=C(C=C2)C(=O)O)C |
| InChIKey | JXAHGEJYVXYTAF-UHFFFAOYSA-N |
Product Overview
4-[(Mesitylsulfonyl)amino]benzoic acid (CAS 166405-50-1), with molecular formula C16H17NO4S and molecular weight 319.09 g/mol. IUPAC: 4-[(2,4,6-trimethylphenyl)sulfonylamino]benzoic acid.
Chemical Property Profile of 4-[(Mesitylsulfonyl)amino]benzoic acid
Property Insights of 4-[(Mesitylsulfonyl)amino]benzoic acid
The XLogP value of 3.1 indicates that 4-[(Mesitylsulfonyl)amino]benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(Mesitylsulfonyl)amino]benzoic acid. Following Lipinski's Rule of Five, 4-[(Mesitylsulfonyl)amino]benzoic acid has 2 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 4-[(Mesitylsulfonyl)amino]benzoic acid?
The CAS number of 4-[(Mesitylsulfonyl)amino]benzoic acid is 166405-50-1.
What is the molecular formula of 4-[(Mesitylsulfonyl)amino]benzoic acid?
The molecular formula of 4-[(Mesitylsulfonyl)amino]benzoic acid is C16H17NO4S.
What is the molecular weight of 4-[(Mesitylsulfonyl)amino]benzoic acid?
The molecular weight of 4-[(Mesitylsulfonyl)amino]benzoic acid is 319.09 g/mol.
Where can I buy 4-[(Mesitylsulfonyl)amino]benzoic acid?
You can request a quote for 4-[(Mesitylsulfonyl)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-[(Mesitylsulfonyl)amino]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[(Mesitylsulfonyl)amino]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.