![[3-Ethoxy-3-oxo-2-[(2-phenylacetyl)amino]prop-1-enyl] benzoate structure](/static/products/7251/7251-81-2.webp)
[3-Ethoxy-3-oxo-2-[(2-phenylacetyl)amino]prop-1-enyl] benzoate
TL;DR: [3-Ethoxy-3-oxo-2-[(2-phenylacetyl)amino]prop-1-enyl] benzoate (CAS 7251-81-2) is a chemical compound with molecular formula C20H19NO5 and molecular weight 353.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-ethoxy-3-oxo-2-[(2-phenylacetyl)amino]prop-1-enyl] benzoate
Also Known As: [(E)-3-ethoxy-3-oxo-2-[(2-phenylacetyl)amino]prop-1-enyl] be|[3-ethoxy-3-oxo-2-[(2-phenylacetyl)amino]prop-1-enyl] benzoate|3-ethoxy-3-oxo-2-[(phenylacetyl)amino]prop-1-en-1-yl benzoate|SMR001548082
| Molecular Formula | C20H19NO5 |
|---|---|
| Molecular Weight | 353.13 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 353.1263 |
| Heavy Atoms | 26 |
| Complexity | 516.0 |
Chemical Identifiers
| CAS Number | 7251-81-2 |
|---|---|
| SMILES | CCOC(=O)C(=COC(=O)C1=CC=CC=C1)NC(=O)CC2=CC=CC=C2 |
| InChIKey | JFGDJEPGHSCLDA-UHFFFAOYSA-N |
Product Overview
[3-Ethoxy-3-oxo-2-[(2-phenylacetyl)amino]prop-1-enyl] benzoate (CAS 7251-81-2), with molecular formula C20H19NO5 and molecular weight 353.13 g/mol. IUPAC: [3-ethoxy-3-oxo-2-[(2-phenylacetyl)amino]prop-1-enyl] benzoate.
Chemical Property Profile of [3-Ethoxy-3-oxo-2-[(2-phenylacetyl)amino]prop-1-enyl] benzoate
Property Insights of [3-Ethoxy-3-oxo-2-[(2-phenylacetyl)amino]prop-1-enyl] benzoate
The XLogP value of 3.1 indicates that [3-Ethoxy-3-oxo-2-[(2-phenylacetyl)amino]prop-1-enyl] benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for [3-Ethoxy-3-oxo-2-[(2-phenylacetyl)amino]prop-1-enyl] benzoate. Following Lipinski's Rule of Five, [3-Ethoxy-3-oxo-2-[(2-phenylacetyl)amino]prop-1-enyl] benzoate 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 [3-Ethoxy-3-oxo-2-[(2-phenylacetyl)amino]prop-1-enyl] benzoate?
The CAS number of [3-Ethoxy-3-oxo-2-[(2-phenylacetyl)amino]prop-1-enyl] benzoate is 7251-81-2.
What is the molecular formula of [3-Ethoxy-3-oxo-2-[(2-phenylacetyl)amino]prop-1-enyl] benzoate?
The molecular formula of [3-Ethoxy-3-oxo-2-[(2-phenylacetyl)amino]prop-1-enyl] benzoate is C20H19NO5.
What is the molecular weight of [3-Ethoxy-3-oxo-2-[(2-phenylacetyl)amino]prop-1-enyl] benzoate?
The molecular weight of [3-Ethoxy-3-oxo-2-[(2-phenylacetyl)amino]prop-1-enyl] benzoate is 353.13 g/mol.
Where can I buy [3-Ethoxy-3-oxo-2-[(2-phenylacetyl)amino]prop-1-enyl] benzoate?
You can request a quote for [3-Ethoxy-3-oxo-2-[(2-phenylacetyl)amino]prop-1-enyl] benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [3-Ethoxy-3-oxo-2-[(2-phenylacetyl)amino]prop-1-enyl] benzoate?
Yes, KEHONG BIO provides custom synthesis services for [3-Ethoxy-3-oxo-2-[(2-phenylacetyl)amino]prop-1-enyl] benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.