2-(((4-Bromo-3-(diethylsulfamoyl)phenyl)carbonyl)amino)benzoic acid
TL;DR: 2-(((4-Bromo-3-(diethylsulfamoyl)phenyl)carbonyl)amino)benzoic acid (CAS 415703-23-0) is a chemical compound with molecular formula C18H19BrN2O5S and molecular weight 454.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-bromo-3-(diethylsulfamoyl)benzoyl]amino]benzoic acid
Also Known As: Diethylsulfonamide Derivative,13a, Diethylsulfonamide Derivative, 13a, BAS 00228385, 2-[[4-bromo-3-(diethylsulfamoyl)benzoyl]amino]benzoic acid, 2-({[4-bromo-3-(diethylsulfamoyl)phenyl]carbonyl}amino)benzoic acid
| Molecular Formula | C18H19BrN2O5S |
|---|---|
| Molecular Weight | 454.02 g/mol |
| LogP | 3.4301 |
| Topological Polar Surface Area | 103.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 454.0198 |
| Heavy Atoms | 27 |
| Complexity | 971.46735 |
Chemical Identifiers
| CAS Number | 415703-23-0 |
|---|---|
| SMILES | CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)NC2=CC=CC=C2C(=O)O)Br |
Product Overview
2-(((4-Bromo-3-(diethylsulfamoyl)phenyl)carbonyl)amino)benzoic acid (CAS 415703-23-0), with molecular formula C18H19BrN2O5S and molecular weight 454.02 g/mol. IUPAC: 2-[[4-bromo-3-(diethylsulfamoyl)benzoyl]amino]benzoic acid.
Chemical Property Profile of 2-(((4-Bromo-3-(diethylsulfamoyl)phenyl)carbonyl)amino)benzoic acid
Property Insights of 2-(((4-Bromo-3-(diethylsulfamoyl)phenyl)carbonyl)amino)benzoic acid
The XLogP value of 3.4301 indicates that 2-(((4-Bromo-3-(diethylsulfamoyl)phenyl)carbonyl)amino)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.78 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(((4-Bromo-3-(diethylsulfamoyl)phenyl)carbonyl)amino)benzoic acid. Following Lipinski's Rule of Five, 2-(((4-Bromo-3-(diethylsulfamoyl)phenyl)carbonyl)amino)benzoic acid has 2 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 2-(((4-Bromo-3-(diethylsulfamoyl)phenyl)carbonyl)amino)benzoic acid?
The CAS number of 2-(((4-Bromo-3-(diethylsulfamoyl)phenyl)carbonyl)amino)benzoic acid is 415703-23-0.
What is the molecular formula of 2-(((4-Bromo-3-(diethylsulfamoyl)phenyl)carbonyl)amino)benzoic acid?
The molecular formula of 2-(((4-Bromo-3-(diethylsulfamoyl)phenyl)carbonyl)amino)benzoic acid is C18H19BrN2O5S.
What is the molecular weight of 2-(((4-Bromo-3-(diethylsulfamoyl)phenyl)carbonyl)amino)benzoic acid?
The molecular weight of 2-(((4-Bromo-3-(diethylsulfamoyl)phenyl)carbonyl)amino)benzoic acid is 454.02 g/mol.
Where can I buy 2-(((4-Bromo-3-(diethylsulfamoyl)phenyl)carbonyl)amino)benzoic acid?
You can request a quote for 2-(((4-Bromo-3-(diethylsulfamoyl)phenyl)carbonyl)amino)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-(((4-Bromo-3-(diethylsulfamoyl)phenyl)carbonyl)amino)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(((4-Bromo-3-(diethylsulfamoyl)phenyl)carbonyl)amino)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.