![3-[(5-Carboxypentyl)sulfamoyl]-4-chlorobenzoic acid structure](/static/products/6111/611196-36-2.webp)
3-[(5-Carboxypentyl)sulfamoyl]-4-chlorobenzoic acid
TL;DR: 3-[(5-Carboxypentyl)sulfamoyl]-4-chlorobenzoic acid (CAS 611196-36-2) is a chemical compound with molecular formula C13H16ClNO6S and molecular weight 349.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(5-carboxypentylsulfamoyl)-4-chlorobenzoic acid
Also Known As: 3-[(5-carboxypentyl)sulfamoyl]-4-chlorobenzoic acid, 3-(5-carboxypentylsulfamoyl)-4-chloro-benzoic Acid, 4-chloro-3-[(6-hydroxy-6-oxohexyl)sulfamoyl]benzoic acid
| Molecular Formula | C13H16ClNO6S |
|---|---|
| Molecular Weight | 349.04 g/mol |
| LogP | 1.9615 |
| Topological Polar Surface Area | 120.77 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 349.0387 |
| Heavy Atoms | 22 |
| Complexity | 658.4942 |
Chemical Identifiers
| CAS Number | 611196-36-2 |
|---|---|
| SMILES | C1=CC(=C(C=C1C(=O)O)S(=O)(=O)NCCCCCC(=O)O)Cl |
Product Overview
3-[(5-Carboxypentyl)sulfamoyl]-4-chlorobenzoic acid (CAS 611196-36-2), with molecular formula C13H16ClNO6S and molecular weight 349.04 g/mol. IUPAC: 3-(5-carboxypentylsulfamoyl)-4-chlorobenzoic acid.
Chemical Property Profile of 3-[(5-Carboxypentyl)sulfamoyl]-4-chlorobenzoic acid
Property Insights of 3-[(5-Carboxypentyl)sulfamoyl]-4-chlorobenzoic acid
The XLogP value of 1.9615 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(5-Carboxypentyl)sulfamoyl]-4-chlorobenzoic acid. The TPSA of 120.77 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(5-Carboxypentyl)sulfamoyl]-4-chlorobenzoic acid. Following Lipinski's Rule of Five, 3-[(5-Carboxypentyl)sulfamoyl]-4-chlorobenzoic acid has 3 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-[(5-Carboxypentyl)sulfamoyl]-4-chlorobenzoic acid?
The CAS number of 3-[(5-Carboxypentyl)sulfamoyl]-4-chlorobenzoic acid is 611196-36-2.
What is the molecular formula of 3-[(5-Carboxypentyl)sulfamoyl]-4-chlorobenzoic acid?
The molecular formula of 3-[(5-Carboxypentyl)sulfamoyl]-4-chlorobenzoic acid is C13H16ClNO6S.
What is the molecular weight of 3-[(5-Carboxypentyl)sulfamoyl]-4-chlorobenzoic acid?
The molecular weight of 3-[(5-Carboxypentyl)sulfamoyl]-4-chlorobenzoic acid is 349.04 g/mol.
Where can I buy 3-[(5-Carboxypentyl)sulfamoyl]-4-chlorobenzoic acid?
You can request a quote for 3-[(5-Carboxypentyl)sulfamoyl]-4-chlorobenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(5-Carboxypentyl)sulfamoyl]-4-chlorobenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[(5-Carboxypentyl)sulfamoyl]-4-chlorobenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.