Ethyl 3-(2-phenylacetamido)propanoate
TL;DR: Ethyl 3-(2-phenylacetamido)propanoate (CAS 66825-20-5) is a chemical compound with molecular formula C13H17NO3 and molecular weight 235.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[(2-phenylacetyl)amino]propanoate
Also Known As: ethyl N-(phenylacetyl)-beta-alaninate, ETHYL 3-(2-PHENYLACETAMIDO)PROPANOATE, ethyl 3-[(2-phenylacetyl)amino]propanoate, AB00102204-01
| Molecular Formula | C13H17NO3 |
|---|---|
| Molecular Weight | 235.12 g/mol |
| LogP | 1.2985 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 235.12085 |
| Heavy Atoms | 17 |
| Complexity | 362.18713 |
Chemical Identifiers
| CAS Number | 66825-20-5 |
|---|---|
| SMILES | CCOC(=O)CCNC(=O)CC1=CC=CC=C1 |
Product Overview
Ethyl 3-(2-phenylacetamido)propanoate (CAS 66825-20-5), with molecular formula C13H17NO3 and molecular weight 235.12 g/mol. IUPAC: ethyl 3-[(2-phenylacetyl)amino]propanoate.
Chemical Property Profile of Ethyl 3-(2-phenylacetamido)propanoate
Property Insights of Ethyl 3-(2-phenylacetamido)propanoate
The XLogP value of 1.2985 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-(2-phenylacetamido)propanoate. With a topological polar surface area (TPSA) of 55.4 Ų, Ethyl 3-(2-phenylacetamido)propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 3-(2-phenylacetamido)propanoate has 1 hydrogen bond donor(s) and 3 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-(2-phenylacetamido)propanoate?
The CAS number of Ethyl 3-(2-phenylacetamido)propanoate is 66825-20-5.
What is the molecular formula of Ethyl 3-(2-phenylacetamido)propanoate?
The molecular formula of Ethyl 3-(2-phenylacetamido)propanoate is C13H17NO3.
What is the molecular weight of Ethyl 3-(2-phenylacetamido)propanoate?
The molecular weight of Ethyl 3-(2-phenylacetamido)propanoate is 235.12 g/mol.
Where can I buy Ethyl 3-(2-phenylacetamido)propanoate?
You can request a quote for Ethyl 3-(2-phenylacetamido)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-(2-phenylacetamido)propanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-(2-phenylacetamido)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.