![Ethyl [(3-bromo-4,5-dimethoxybenzoyl)amino]acetate structure](/static/products/342/342589-62-2.png)
Ethyl [(3-bromo-4,5-dimethoxybenzoyl)amino]acetate
TL;DR: Ethyl [(3-bromo-4,5-dimethoxybenzoyl)amino]acetate (CAS 342589-62-2) is a chemical compound with molecular formula C13H16BrNO5 and molecular weight 345.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(3-bromo-4,5-dimethoxybenzoyl)amino]acetate
Also Known As: ethyl [(3-bromo-4,5-dimethoxybenzoyl)amino]acetate, ethyl 2-[(3-bromo-4,5-dimethoxybenzoyl)amino]acetate, AE-641/13516023, ethyl 2-[(3-bromo-4,5-dimethoxyphenyl)formamido]acetate
| Molecular Formula | C13H16BrNO5 |
|---|---|
| Molecular Weight | 345.02 g/mol |
| LogP | 1.7592 |
| Topological Polar Surface Area | 73.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 345.02118 |
| Heavy Atoms | 20 |
| Complexity | 503.78003 |
Chemical Identifiers
| CAS Number | 342589-62-2 |
|---|---|
| SMILES | CCOC(=O)CNC(=O)C1=CC(=C(C(=C1)Br)OC)OC |
Product Overview
Ethyl [(3-bromo-4,5-dimethoxybenzoyl)amino]acetate (CAS 342589-62-2), with molecular formula C13H16BrNO5 and molecular weight 345.02 g/mol. IUPAC: ethyl 2-[(3-bromo-4,5-dimethoxybenzoyl)amino]acetate.
Chemical Property Profile of Ethyl [(3-bromo-4,5-dimethoxybenzoyl)amino]acetate
Property Insights of Ethyl [(3-bromo-4,5-dimethoxybenzoyl)amino]acetate
The XLogP value of 1.7592 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl [(3-bromo-4,5-dimethoxybenzoyl)amino]acetate. The TPSA of 73.86 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl [(3-bromo-4,5-dimethoxybenzoyl)amino]acetate. Following Lipinski's Rule of Five, Ethyl [(3-bromo-4,5-dimethoxybenzoyl)amino]acetate has 1 hydrogen bond donor(s) and 5 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 Ethyl [(3-bromo-4,5-dimethoxybenzoyl)amino]acetate?
The CAS number of Ethyl [(3-bromo-4,5-dimethoxybenzoyl)amino]acetate is 342589-62-2.
What is the molecular formula of Ethyl [(3-bromo-4,5-dimethoxybenzoyl)amino]acetate?
The molecular formula of Ethyl [(3-bromo-4,5-dimethoxybenzoyl)amino]acetate is C13H16BrNO5.
What is the molecular weight of Ethyl [(3-bromo-4,5-dimethoxybenzoyl)amino]acetate?
The molecular weight of Ethyl [(3-bromo-4,5-dimethoxybenzoyl)amino]acetate is 345.02 g/mol.
Where can I buy Ethyl [(3-bromo-4,5-dimethoxybenzoyl)amino]acetate?
You can request a quote for Ethyl [(3-bromo-4,5-dimethoxybenzoyl)amino]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl [(3-bromo-4,5-dimethoxybenzoyl)amino]acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl [(3-bromo-4,5-dimethoxybenzoyl)amino]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.