Methyl 5-bromo-2-(2-phenoxyacetamido)benzoate
TL;DR: Methyl 5-bromo-2-(2-phenoxyacetamido)benzoate (CAS 452349-89-2) 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 5-bromo-2-[(2-phenoxyacetyl)amino]benzoate
Also Known As: Methyl 5-bromo-2-(2-phenoxyacetamido)benzoate, methyl 5-bromo-2-[(2-phenoxyacetyl)amino]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 | 673.10095 |
Chemical Identifiers
| CAS Number | 452349-89-2 |
|---|---|
| SMILES | COC(=O)C1=C(C=CC(=C1)Br)NC(=O)COC2=CC=CC=C2 |
Product Overview
Methyl 5-bromo-2-(2-phenoxyacetamido)benzoate (CAS 452349-89-2), with molecular formula C16H14BrNO4 and molecular weight 363.01 g/mol. IUPAC: methyl 5-bromo-2-[(2-phenoxyacetyl)amino]benzoate.
Chemical Property Profile of Methyl 5-bromo-2-(2-phenoxyacetamido)benzoate
Property Insights of Methyl 5-bromo-2-(2-phenoxyacetamido)benzoate
The XLogP value of 3.2532 indicates that Methyl 5-bromo-2-(2-phenoxyacetamido)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 5-bromo-2-(2-phenoxyacetamido)benzoate. Following Lipinski's Rule of Five, Methyl 5-bromo-2-(2-phenoxyacetamido)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 5-bromo-2-(2-phenoxyacetamido)benzoate?
The CAS number of Methyl 5-bromo-2-(2-phenoxyacetamido)benzoate is 452349-89-2.
What is the molecular formula of Methyl 5-bromo-2-(2-phenoxyacetamido)benzoate?
The molecular formula of Methyl 5-bromo-2-(2-phenoxyacetamido)benzoate is C16H14BrNO4.
What is the molecular weight of Methyl 5-bromo-2-(2-phenoxyacetamido)benzoate?
The molecular weight of Methyl 5-bromo-2-(2-phenoxyacetamido)benzoate is 363.01 g/mol.
Where can I buy Methyl 5-bromo-2-(2-phenoxyacetamido)benzoate?
You can request a quote for Methyl 5-bromo-2-(2-phenoxyacetamido)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 5-bromo-2-(2-phenoxyacetamido)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 5-bromo-2-(2-phenoxyacetamido)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.