![4-[(Pyridin-4-ylmethyl)-sulfamoyl]-benzoic acid structure](/static/products/4360/436091-71-3.webp)
4-[(Pyridin-4-ylmethyl)-sulfamoyl]-benzoic acid
TL;DR: 4-[(Pyridin-4-ylmethyl)-sulfamoyl]-benzoic acid (CAS 436091-71-3) 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.
4-(pyridin-4-ylmethylsulfamoyl)benzoic acid
Also Known As: 4-(pyridin-4-ylmethylsulfamoyl)benzoic Acid, 4-[ -SULFAMOYL]-BENZOICACID, 4-[(PYRIDIN-4-YLMETHYL)-SULFAMOYL]-BENZOIC ACID, 4-{[(Pyridin-4-yl)methyl]sulfamoyl}benzoic acid, 4-[((PYRIDIN-4-YL)METHYL)-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 | 696.9108 |
Chemical Identifiers
| CAS Number | 436091-71-3 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)O)S(=O)(=O)NCC2=CC=NC=C2 |
Product Overview
4-[(Pyridin-4-ylmethyl)-sulfamoyl]-benzoic acid (CAS 436091-71-3), with molecular formula C13H12N2O4S and molecular weight 292.05 g/mol. IUPAC: 4-(pyridin-4-ylmethylsulfamoyl)benzoic acid.
Chemical Property Profile of 4-[(Pyridin-4-ylmethyl)-sulfamoyl]-benzoic acid
Property Insights of 4-[(Pyridin-4-ylmethyl)-sulfamoyl]-benzoic acid
The XLogP value of 1.2583 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(Pyridin-4-ylmethyl)-sulfamoyl]-benzoic acid. The TPSA of 96.36 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(Pyridin-4-ylmethyl)-sulfamoyl]-benzoic acid. Following Lipinski's Rule of Five, 4-[(Pyridin-4-ylmethyl)-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 4-[(Pyridin-4-ylmethyl)-sulfamoyl]-benzoic acid?
The CAS number of 4-[(Pyridin-4-ylmethyl)-sulfamoyl]-benzoic acid is 436091-71-3.
What is the molecular formula of 4-[(Pyridin-4-ylmethyl)-sulfamoyl]-benzoic acid?
The molecular formula of 4-[(Pyridin-4-ylmethyl)-sulfamoyl]-benzoic acid is C13H12N2O4S.
What is the molecular weight of 4-[(Pyridin-4-ylmethyl)-sulfamoyl]-benzoic acid?
The molecular weight of 4-[(Pyridin-4-ylmethyl)-sulfamoyl]-benzoic acid is 292.05 g/mol.
Where can I buy 4-[(Pyridin-4-ylmethyl)-sulfamoyl]-benzoic acid?
You can request a quote for 4-[(Pyridin-4-ylmethyl)-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 4-[(Pyridin-4-ylmethyl)-sulfamoyl]-benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[(Pyridin-4-ylmethyl)-sulfamoyl]-benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.