![3-[Benzyl(2-methoxyphenyl)sulfamoyl]-4-chlorobenzoic acid structure](/static/products/5651/565166-97-4.webp)
3-[Benzyl(2-methoxyphenyl)sulfamoyl]-4-chlorobenzoic acid
TL;DR: 3-[Benzyl(2-methoxyphenyl)sulfamoyl]-4-chlorobenzoic acid (CAS 565166-97-4) is a chemical compound with molecular formula C21H18ClNO5S and molecular weight 431.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[benzyl-(2-methoxyphenyl)sulfamoyl]-4-chlorobenzoic acid
Also Known As: 3-[benzyl(2-methoxyphenyl)sulfamoyl]-4-chlorobenzoic acid, 3-[Benzyl-(2-methoxy-phenyl)-sulfamoyl]-4-chloro-benzoic acid, 3-[benzyl-(2-methoxyphenyl)sulfamoyl]-4-chlorobenzoic acid, 3-[benzyl(2-methoxyphenyl)sulfamoyl]-4-chlorobenzoicacid, 3-[benzyl-(2-methoxyphenyl)sulfamoyl]-4-chloro-benzoic Acid
| Molecular Formula | C21H18ClNO5S |
|---|---|
| Molecular Weight | 431.06 g/mol |
| LogP | 4.4423 |
| Topological Polar Surface Area | 83.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 431.05942 |
| Heavy Atoms | 29 |
| Complexity | 1132.8182 |
Chemical Identifiers
| CAS Number | 565166-97-4 |
|---|---|
| SMILES | COC1=CC=CC=C1N(CC2=CC=CC=C2)S(=O)(=O)C3=C(C=CC(=C3)C(=O)O)Cl |
Product Overview
3-[Benzyl(2-methoxyphenyl)sulfamoyl]-4-chlorobenzoic acid (CAS 565166-97-4), with molecular formula C21H18ClNO5S and molecular weight 431.06 g/mol. IUPAC: 3-[benzyl-(2-methoxyphenyl)sulfamoyl]-4-chlorobenzoic acid.
Chemical Property Profile of 3-[Benzyl(2-methoxyphenyl)sulfamoyl]-4-chlorobenzoic acid
Property Insights of 3-[Benzyl(2-methoxyphenyl)sulfamoyl]-4-chlorobenzoic acid
The XLogP value of 4.4423 indicates that 3-[Benzyl(2-methoxyphenyl)sulfamoyl]-4-chlorobenzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[Benzyl(2-methoxyphenyl)sulfamoyl]-4-chlorobenzoic acid. Following Lipinski's Rule of Five, 3-[Benzyl(2-methoxyphenyl)sulfamoyl]-4-chlorobenzoic acid has 1 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-[Benzyl(2-methoxyphenyl)sulfamoyl]-4-chlorobenzoic acid?
The CAS number of 3-[Benzyl(2-methoxyphenyl)sulfamoyl]-4-chlorobenzoic acid is 565166-97-4.
What is the molecular formula of 3-[Benzyl(2-methoxyphenyl)sulfamoyl]-4-chlorobenzoic acid?
The molecular formula of 3-[Benzyl(2-methoxyphenyl)sulfamoyl]-4-chlorobenzoic acid is C21H18ClNO5S.
What is the molecular weight of 3-[Benzyl(2-methoxyphenyl)sulfamoyl]-4-chlorobenzoic acid?
The molecular weight of 3-[Benzyl(2-methoxyphenyl)sulfamoyl]-4-chlorobenzoic acid is 431.06 g/mol.
Where can I buy 3-[Benzyl(2-methoxyphenyl)sulfamoyl]-4-chlorobenzoic acid?
You can request a quote for 3-[Benzyl(2-methoxyphenyl)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-[Benzyl(2-methoxyphenyl)sulfamoyl]-4-chlorobenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[Benzyl(2-methoxyphenyl)sulfamoyl]-4-chlorobenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.