![2-Chloro-5-[(4-fluorophenyl)sulfamoyl]benzoic acid structure](/static/products/3132/313225-61-5.webp)
2-Chloro-5-[(4-fluorophenyl)sulfamoyl]benzoic acid
TL;DR: 2-Chloro-5-[(4-fluorophenyl)sulfamoyl]benzoic acid (CAS 313225-61-5) is a chemical compound with molecular formula C13H9ClFNO4S and molecular weight 328.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-5-[(4-fluorophenyl)sulfamoyl]benzoic acid
Also Known As: 2-chloro-5-[(4-fluorophenyl)sulfamoyl]benzoic acid, Sulpiride impurity 24, 2-Chloro-5-(4-fluoro-phenylsulfamoyl)-benzoic acid, BAS 00315571, 2-chloro-5-[(4-fluorophenyl)sulfamoyl]benzoicacid
| Molecular Formula | C13H9ClFNO4S |
|---|---|
| Molecular Weight | 328.99 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 91.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 328.9925 |
| Heavy Atoms | 21 |
| Complexity | 473.0 |
Chemical Identifiers
| CAS Number | 313225-61-5 |
|---|---|
| SMILES | C1=CC(=CC=C1NS(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)O)F |
| InChIKey | XIJVRDKNVIPWNE-UHFFFAOYSA-N |
Product Overview
2-Chloro-5-[(4-fluorophenyl)sulfamoyl]benzoic acid (CAS 313225-61-5), with molecular formula C13H9ClFNO4S and molecular weight 328.99 g/mol. IUPAC: 2-chloro-5-[(4-fluorophenyl)sulfamoyl]benzoic acid.
Chemical Property Profile of 2-Chloro-5-[(4-fluorophenyl)sulfamoyl]benzoic acid
Property Insights of 2-Chloro-5-[(4-fluorophenyl)sulfamoyl]benzoic acid
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloro-5-[(4-fluorophenyl)sulfamoyl]benzoic acid. The TPSA of 91.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Chloro-5-[(4-fluorophenyl)sulfamoyl]benzoic acid. Following Lipinski's Rule of Five, 2-Chloro-5-[(4-fluorophenyl)sulfamoyl]benzoic acid has 2 hydrogen bond donor(s) and 6 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 2-Chloro-5-[(4-fluorophenyl)sulfamoyl]benzoic acid?
The CAS number of 2-Chloro-5-[(4-fluorophenyl)sulfamoyl]benzoic acid is 313225-61-5.
What is the molecular formula of 2-Chloro-5-[(4-fluorophenyl)sulfamoyl]benzoic acid?
The molecular formula of 2-Chloro-5-[(4-fluorophenyl)sulfamoyl]benzoic acid is C13H9ClFNO4S.
What is the molecular weight of 2-Chloro-5-[(4-fluorophenyl)sulfamoyl]benzoic acid?
The molecular weight of 2-Chloro-5-[(4-fluorophenyl)sulfamoyl]benzoic acid is 328.99 g/mol.
Where can I buy 2-Chloro-5-[(4-fluorophenyl)sulfamoyl]benzoic acid?
You can request a quote for 2-Chloro-5-[(4-fluorophenyl)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 2-Chloro-5-[(4-fluorophenyl)sulfamoyl]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-5-[(4-fluorophenyl)sulfamoyl]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.