3-(((Pyridin-3-yl)methyl)sulfamoyl)benzoic acid
TL;DR: 3-(((Pyridin-3-yl)methyl)sulfamoyl)benzoic acid (CAS 733031-16-8) is a chemical compound with molecular formula C13H12N2O4S and molecular weight 292.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(pyridin-3-ylmethylsulfamoyl)benzoic acid
Also Known As: 3-[(pyridin-3-ylmethyl)sulfamoyl]benzoic acid, 3-{[(pyridin-3-yl)methyl]sulfamoyl}benzoic acid, 3-(pyridin-3-ylmethylsulfamoyl)benzoic Acid, 3-([(Pyridin-3-ylmethyl)amino]sulfonyl)benzoic acid, 3-(N-(PYRIDIN-3-YLMETHYL)SULFAMOYL)BENZOIC ACID
| Molecular Formula | C13H12N2O4S |
|---|---|
| Molecular Weight | 292.05 g/mol |
| LogP | 1.2583 |
| Topological Polar Surface Area | 96.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 292.0518 |
| Heavy Atoms | 20 |
| Complexity | 714.1608 |
Chemical Identifiers
| CAS Number | 733031-16-8 |
|---|---|
| SMILES | C1=CC(=CC(=C1)S(=O)(=O)NCC2=CN=CC=C2)C(=O)O |
Product Overview
3-(((Pyridin-3-yl)methyl)sulfamoyl)benzoic acid (CAS 733031-16-8), with molecular formula C13H12N2O4S and molecular weight 292.05 g/mol. IUPAC: 3-(pyridin-3-ylmethylsulfamoyl)benzoic acid.
Chemical Property Profile of 3-(((Pyridin-3-yl)methyl)sulfamoyl)benzoic acid
Property Insights of 3-(((Pyridin-3-yl)methyl)sulfamoyl)benzoic acid
The XLogP value of 1.2583 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(((Pyridin-3-yl)methyl)sulfamoyl)benzoic acid. The TPSA of 96.36 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(((Pyridin-3-yl)methyl)sulfamoyl)benzoic acid. Following Lipinski's Rule of Five, 3-(((Pyridin-3-yl)methyl)sulfamoyl)benzoic acid has 2 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 3-(((Pyridin-3-yl)methyl)sulfamoyl)benzoic acid?
The CAS number of 3-(((Pyridin-3-yl)methyl)sulfamoyl)benzoic acid is 733031-16-8.
What is the molecular formula of 3-(((Pyridin-3-yl)methyl)sulfamoyl)benzoic acid?
The molecular formula of 3-(((Pyridin-3-yl)methyl)sulfamoyl)benzoic acid is C13H12N2O4S.
What is the molecular weight of 3-(((Pyridin-3-yl)methyl)sulfamoyl)benzoic acid?
The molecular weight of 3-(((Pyridin-3-yl)methyl)sulfamoyl)benzoic acid is 292.05 g/mol.
Where can I buy 3-(((Pyridin-3-yl)methyl)sulfamoyl)benzoic acid?
You can request a quote for 3-(((Pyridin-3-yl)methyl)sulfamoyl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(((Pyridin-3-yl)methyl)sulfamoyl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(((Pyridin-3-yl)methyl)sulfamoyl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.