Methyl 2-{[(4-bromophenyl)sulfonyl]amino}benzoate
TL;DR: Methyl 2-{[(4-bromophenyl)sulfonyl]amino}benzoate (CAS 349404-83-7) is a chemical compound with molecular formula C14H12BrNO4S and molecular weight 368.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(4-bromophenyl)sulfonylamino]benzoate
Also Known As: methyl 2-{[(4-bromophenyl)sulfonyl]amino}benzoate, methyl 2-[(4-bromophenyl)sulfonylamino]benzoate, METHYL 2-(4-BROMOBENZENESULFONAMIDO)BENZOATE, methyl 2-(4-bromophenylsulfonamido)benzoate, BAS 01358591
| Molecular Formula | C14H12BrNO4S |
|---|---|
| Molecular Weight | 368.97 g/mol |
| LogP | 3.0365 |
| Topological Polar Surface Area | 72.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 368.96704 |
| Heavy Atoms | 21 |
| Complexity | 756.7984 |
Chemical Identifiers
| CAS Number | 349404-83-7 |
|---|---|
| SMILES | COC(=O)C1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)Br |
Product Overview
Methyl 2-{[(4-bromophenyl)sulfonyl]amino}benzoate (CAS 349404-83-7), with molecular formula C14H12BrNO4S and molecular weight 368.97 g/mol. IUPAC: methyl 2-[(4-bromophenyl)sulfonylamino]benzoate.
Chemical Property Profile of Methyl 2-{[(4-bromophenyl)sulfonyl]amino}benzoate
Property Insights of Methyl 2-{[(4-bromophenyl)sulfonyl]amino}benzoate
The XLogP value of 3.0365 indicates that Methyl 2-{[(4-bromophenyl)sulfonyl]amino}benzoate 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 2-{[(4-bromophenyl)sulfonyl]amino}benzoate. Following Lipinski's Rule of Five, Methyl 2-{[(4-bromophenyl)sulfonyl]amino}benzoate 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 2-{[(4-bromophenyl)sulfonyl]amino}benzoate?
The CAS number of Methyl 2-{[(4-bromophenyl)sulfonyl]amino}benzoate is 349404-83-7.
What is the molecular formula of Methyl 2-{[(4-bromophenyl)sulfonyl]amino}benzoate?
The molecular formula of Methyl 2-{[(4-bromophenyl)sulfonyl]amino}benzoate is C14H12BrNO4S.
What is the molecular weight of Methyl 2-{[(4-bromophenyl)sulfonyl]amino}benzoate?
The molecular weight of Methyl 2-{[(4-bromophenyl)sulfonyl]amino}benzoate is 368.97 g/mol.
Where can I buy Methyl 2-{[(4-bromophenyl)sulfonyl]amino}benzoate?
You can request a quote for Methyl 2-{[(4-bromophenyl)sulfonyl]amino}benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-{[(4-bromophenyl)sulfonyl]amino}benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-{[(4-bromophenyl)sulfonyl]amino}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.