![Methyl 5-[(4-bromophenyl)sulfamoyl]-2-chlorobenzoate structure](/static/products/5558/5558-44-1.webp)
Methyl 5-[(4-bromophenyl)sulfamoyl]-2-chlorobenzoate
TL;DR: Methyl 5-[(4-bromophenyl)sulfamoyl]-2-chlorobenzoate (CAS 5558-44-1) is a chemical compound with molecular formula C14H11BrClNO4S and molecular weight 402.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-[(4-bromophenyl)sulfamoyl]-2-chlorobenzoate
Also Known As: methyl 5-[(4-bromophenyl)sulfamoyl]-2-chlorobenzoate, AB00089097-01, methyl 5-{[(4-bromophenyl)amino]sulfonyl}-2-chlorobenzoate
| Molecular Formula | C14H11BrClNO4S |
|---|---|
| Molecular Weight | 402.93 g/mol |
| LogP | 3.6899 |
| Topological Polar Surface Area | 72.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 402.92807 |
| Heavy Atoms | 22 |
| Complexity | 806.0926 |
Chemical Identifiers
| CAS Number | 5558-44-1 |
|---|---|
| SMILES | COC(=O)C1=C(C=CC(=C1)S(=O)(=O)NC2=CC=C(C=C2)Br)Cl |
Product Overview
Methyl 5-[(4-bromophenyl)sulfamoyl]-2-chlorobenzoate (CAS 5558-44-1), with molecular formula C14H11BrClNO4S and molecular weight 402.93 g/mol. IUPAC: methyl 5-[(4-bromophenyl)sulfamoyl]-2-chlorobenzoate.
Chemical Property Profile of Methyl 5-[(4-bromophenyl)sulfamoyl]-2-chlorobenzoate
Property Insights of Methyl 5-[(4-bromophenyl)sulfamoyl]-2-chlorobenzoate
The XLogP value of 3.6899 indicates that Methyl 5-[(4-bromophenyl)sulfamoyl]-2-chlorobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.47 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 5-[(4-bromophenyl)sulfamoyl]-2-chlorobenzoate. Following Lipinski's Rule of Five, Methyl 5-[(4-bromophenyl)sulfamoyl]-2-chlorobenzoate 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 Methyl 5-[(4-bromophenyl)sulfamoyl]-2-chlorobenzoate?
The CAS number of Methyl 5-[(4-bromophenyl)sulfamoyl]-2-chlorobenzoate is 5558-44-1.
What is the molecular formula of Methyl 5-[(4-bromophenyl)sulfamoyl]-2-chlorobenzoate?
The molecular formula of Methyl 5-[(4-bromophenyl)sulfamoyl]-2-chlorobenzoate is C14H11BrClNO4S.
What is the molecular weight of Methyl 5-[(4-bromophenyl)sulfamoyl]-2-chlorobenzoate?
The molecular weight of Methyl 5-[(4-bromophenyl)sulfamoyl]-2-chlorobenzoate is 402.93 g/mol.
Where can I buy Methyl 5-[(4-bromophenyl)sulfamoyl]-2-chlorobenzoate?
You can request a quote for Methyl 5-[(4-bromophenyl)sulfamoyl]-2-chlorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 5-[(4-bromophenyl)sulfamoyl]-2-chlorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 5-[(4-bromophenyl)sulfamoyl]-2-chlorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.