3-((4-Butylphenyl)sulfamoyl)-4-methylbenzoic acid
TL;DR: 3-((4-Butylphenyl)sulfamoyl)-4-methylbenzoic acid (CAS 377769-67-0) is a chemical compound with molecular formula C18H21NO4S and molecular weight 347.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-butylphenyl)sulfamoyl]-4-methylbenzoic acid
Also Known As: 3-[(4-butylphenyl)sulfamoyl]-4-methylbenzoic acid, 3-(4-Butyl-phenylsulfamoyl)-4-methyl-benzoic acid, 3-[(4-butylphenyl)sulfamoyl]-4-methylbenzoicacid, 3-((4-Butylphenyl)sulfamoyl)-4-methylbenzoic acid, 3-[(4-butylphenyl)sulfamoyl]-4-methyl-benzoic Acid
| Molecular Formula | C18H21NO4S |
|---|---|
| Molecular Weight | 347.12 g/mol |
| LogP | 3.83662 |
| Topological Polar Surface Area | 83.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 347.11914 |
| Heavy Atoms | 24 |
| Complexity | 826.5973 |
Chemical Identifiers
| CAS Number | 377769-67-0 |
|---|---|
| SMILES | CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)O)C |
Product Overview
3-((4-Butylphenyl)sulfamoyl)-4-methylbenzoic acid (CAS 377769-67-0), with molecular formula C18H21NO4S and molecular weight 347.12 g/mol. IUPAC: 3-[(4-butylphenyl)sulfamoyl]-4-methylbenzoic acid.
Chemical Property Profile of 3-((4-Butylphenyl)sulfamoyl)-4-methylbenzoic acid
Property Insights of 3-((4-Butylphenyl)sulfamoyl)-4-methylbenzoic acid
The XLogP value of 3.83662 indicates that 3-((4-Butylphenyl)sulfamoyl)-4-methylbenzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-((4-Butylphenyl)sulfamoyl)-4-methylbenzoic acid. Following Lipinski's Rule of Five, 3-((4-Butylphenyl)sulfamoyl)-4-methylbenzoic acid has 2 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 3-((4-Butylphenyl)sulfamoyl)-4-methylbenzoic acid?
The CAS number of 3-((4-Butylphenyl)sulfamoyl)-4-methylbenzoic acid is 377769-67-0.
What is the molecular formula of 3-((4-Butylphenyl)sulfamoyl)-4-methylbenzoic acid?
The molecular formula of 3-((4-Butylphenyl)sulfamoyl)-4-methylbenzoic acid is C18H21NO4S.
What is the molecular weight of 3-((4-Butylphenyl)sulfamoyl)-4-methylbenzoic acid?
The molecular weight of 3-((4-Butylphenyl)sulfamoyl)-4-methylbenzoic acid is 347.12 g/mol.
Where can I buy 3-((4-Butylphenyl)sulfamoyl)-4-methylbenzoic acid?
You can request a quote for 3-((4-Butylphenyl)sulfamoyl)-4-methylbenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-((4-Butylphenyl)sulfamoyl)-4-methylbenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-((4-Butylphenyl)sulfamoyl)-4-methylbenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.