Methyl 2-(2-((4-bromophenyl)amino)-2-oxoethoxy)benzoate
TL;DR: Methyl 2-(2-((4-bromophenyl)amino)-2-oxoethoxy)benzoate (CAS 949969-59-9) is a chemical compound with molecular formula C16H14BrNO4 and molecular weight 363.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[2-(4-bromoanilino)-2-oxoethoxy]benzoate
Also Known As: methyl 2-(2-((4-bromophenyl)amino)-2-oxoethoxy)benzoate, methyl 2-[2-(4-bromoanilino)-2-oxoethoxy]benzoate
| Molecular Formula | C16H14BrNO4 |
|---|---|
| Molecular Weight | 363.01 g/mol |
| LogP | 3.2532 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 363.01062 |
| Heavy Atoms | 22 |
| Complexity | 670.10095 |
Chemical Identifiers
| CAS Number | 949969-59-9 |
|---|---|
| SMILES | COC(=O)C1=CC=CC=C1OCC(=O)NC2=CC=C(C=C2)Br |
Product Overview
Methyl 2-(2-((4-bromophenyl)amino)-2-oxoethoxy)benzoate (CAS 949969-59-9), with molecular formula C16H14BrNO4 and molecular weight 363.01 g/mol. IUPAC: methyl 2-[2-(4-bromoanilino)-2-oxoethoxy]benzoate.
Chemical Property Profile of Methyl 2-(2-((4-bromophenyl)amino)-2-oxoethoxy)benzoate
Property Insights of Methyl 2-(2-((4-bromophenyl)amino)-2-oxoethoxy)benzoate
The XLogP value of 3.2532 indicates that Methyl 2-(2-((4-bromophenyl)amino)-2-oxoethoxy)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-(2-((4-bromophenyl)amino)-2-oxoethoxy)benzoate. Following Lipinski's Rule of Five, Methyl 2-(2-((4-bromophenyl)amino)-2-oxoethoxy)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-(2-((4-bromophenyl)amino)-2-oxoethoxy)benzoate?
The CAS number of Methyl 2-(2-((4-bromophenyl)amino)-2-oxoethoxy)benzoate is 949969-59-9.
What is the molecular formula of Methyl 2-(2-((4-bromophenyl)amino)-2-oxoethoxy)benzoate?
The molecular formula of Methyl 2-(2-((4-bromophenyl)amino)-2-oxoethoxy)benzoate is C16H14BrNO4.
What is the molecular weight of Methyl 2-(2-((4-bromophenyl)amino)-2-oxoethoxy)benzoate?
The molecular weight of Methyl 2-(2-((4-bromophenyl)amino)-2-oxoethoxy)benzoate is 363.01 g/mol.
Where can I buy Methyl 2-(2-((4-bromophenyl)amino)-2-oxoethoxy)benzoate?
You can request a quote for Methyl 2-(2-((4-bromophenyl)amino)-2-oxoethoxy)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-(2-((4-bromophenyl)amino)-2-oxoethoxy)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-(2-((4-bromophenyl)amino)-2-oxoethoxy)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.