5-((3-Bromophenyl)sulfamoyl)-2-fluorobenzoic acid
TL;DR: 5-((3-Bromophenyl)sulfamoyl)-2-fluorobenzoic acid (CAS 1030694-72-4) is a chemical compound with molecular formula C13H9BrFNO4S and molecular weight 372.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(3-bromophenyl)sulfamoyl]-2-fluorobenzoic acid
Also Known As: 5-[(3-bromophenyl)sulfamoyl]-2-fluorobenzoic acid, 5-[(3-bromophenyl)sulfamoyl]-2-fluoro-benzoic Acid, 5-(3-bromophenyl)sulfamoyl-2-fluorobenzoic acid, 5-[(3-bromophenyl)sulfamoyl]-2-fluorobenzoicacid, 5-((3-Bromophenyl)sulfamoyl)-2-fluorobenzoic acid
| Molecular Formula | C13H9BrFNO4S |
|---|---|
| Molecular Weight | 372.94 g/mol |
| LogP | 3.0872 |
| Topological Polar Surface Area | 83.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 372.94196 |
| Heavy Atoms | 21 |
| Complexity | 807.5686 |
Chemical Identifiers
| CAS Number | 1030694-72-4 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Br)NS(=O)(=O)C2=CC(=C(C=C2)F)C(=O)O |
Product Overview
5-((3-Bromophenyl)sulfamoyl)-2-fluorobenzoic acid (CAS 1030694-72-4), with molecular formula C13H9BrFNO4S and molecular weight 372.94 g/mol. IUPAC: 5-[(3-bromophenyl)sulfamoyl]-2-fluorobenzoic acid.
Chemical Property Profile of 5-((3-Bromophenyl)sulfamoyl)-2-fluorobenzoic acid
Property Insights of 5-((3-Bromophenyl)sulfamoyl)-2-fluorobenzoic acid
The XLogP value of 3.0872 indicates that 5-((3-Bromophenyl)sulfamoyl)-2-fluorobenzoic 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 5-((3-Bromophenyl)sulfamoyl)-2-fluorobenzoic acid. Following Lipinski's Rule of Five, 5-((3-Bromophenyl)sulfamoyl)-2-fluorobenzoic 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 5-((3-Bromophenyl)sulfamoyl)-2-fluorobenzoic acid?
The CAS number of 5-((3-Bromophenyl)sulfamoyl)-2-fluorobenzoic acid is 1030694-72-4.
What is the molecular formula of 5-((3-Bromophenyl)sulfamoyl)-2-fluorobenzoic acid?
The molecular formula of 5-((3-Bromophenyl)sulfamoyl)-2-fluorobenzoic acid is C13H9BrFNO4S.
What is the molecular weight of 5-((3-Bromophenyl)sulfamoyl)-2-fluorobenzoic acid?
The molecular weight of 5-((3-Bromophenyl)sulfamoyl)-2-fluorobenzoic acid is 372.94 g/mol.
Where can I buy 5-((3-Bromophenyl)sulfamoyl)-2-fluorobenzoic acid?
You can request a quote for 5-((3-Bromophenyl)sulfamoyl)-2-fluorobenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-((3-Bromophenyl)sulfamoyl)-2-fluorobenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-((3-Bromophenyl)sulfamoyl)-2-fluorobenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.