![(2S)-2-[(4-ethoxy-4-oxobut-2-en-2-yl)amino]-3-phenylpropanoic acid structure](/static/products/5362/53624-48-9.webp)
(2S)-2-[(4-ethoxy-4-oxobut-2-en-2-yl)amino]-3-phenylpropanoic acid
TL;DR: (2S)-2-[(4-ethoxy-4-oxobut-2-en-2-yl)amino]-3-phenylpropanoic acid (CAS 53624-48-9) is a chemical compound with molecular formula C15H19NO4 and molecular weight 277.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[(4-ethoxy-4-oxobut-2-en-2-yl)amino]-3-phenylpropanoic acid
Also Known As: L-Phenylalanine, N-(3-ethoxy-1-methyl-3-oxo-1-propenyl)-, Phenylalanine, N-(3-ethoxy-1-methyl-3-oxo-1-propenyl)-, (2S)-2-[[(E)-1-ethoxycarbonylprop-1-en-2-yl]amino]-3-phenyl-propanoic acid
| Molecular Formula | C15H19NO4 |
|---|---|
| Molecular Weight | 277.13 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 75.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 277.1314 |
| Heavy Atoms | 20 |
| Complexity | 359.0 |
Chemical Identifiers
| CAS Number | 53624-48-9 |
|---|---|
| SMILES | CCOC(=O)C=C(C)N[C@@H](CC1=CC=CC=C1)C(=O)O |
| InChIKey | MTBBUMSUVISXGJ-ZDUSSCGKSA-N |
Product Overview
(2S)-2-[(4-ethoxy-4-oxobut-2-en-2-yl)amino]-3-phenylpropanoic acid (CAS 53624-48-9), with molecular formula C15H19NO4 and molecular weight 277.13 g/mol. IUPAC: (2S)-2-[(4-ethoxy-4-oxobut-2-en-2-yl)amino]-3-phenylpropanoic acid.
Chemical Property Profile of (2S)-2-[(4-ethoxy-4-oxobut-2-en-2-yl)amino]-3-phenylpropanoic acid
Property Insights of (2S)-2-[(4-ethoxy-4-oxobut-2-en-2-yl)amino]-3-phenylpropanoic acid
The XLogP value of 3.2 indicates that (2S)-2-[(4-ethoxy-4-oxobut-2-en-2-yl)amino]-3-phenylpropanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-2-[(4-ethoxy-4-oxobut-2-en-2-yl)amino]-3-phenylpropanoic acid. Following Lipinski's Rule of Five, (2S)-2-[(4-ethoxy-4-oxobut-2-en-2-yl)amino]-3-phenylpropanoic acid has 2 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 (2S)-2-[(4-ethoxy-4-oxobut-2-en-2-yl)amino]-3-phenylpropanoic acid?
The CAS number of (2S)-2-[(4-ethoxy-4-oxobut-2-en-2-yl)amino]-3-phenylpropanoic acid is 53624-48-9.
What is the molecular formula of (2S)-2-[(4-ethoxy-4-oxobut-2-en-2-yl)amino]-3-phenylpropanoic acid?
The molecular formula of (2S)-2-[(4-ethoxy-4-oxobut-2-en-2-yl)amino]-3-phenylpropanoic acid is C15H19NO4.
What is the molecular weight of (2S)-2-[(4-ethoxy-4-oxobut-2-en-2-yl)amino]-3-phenylpropanoic acid?
The molecular weight of (2S)-2-[(4-ethoxy-4-oxobut-2-en-2-yl)amino]-3-phenylpropanoic acid is 277.13 g/mol.
Where can I buy (2S)-2-[(4-ethoxy-4-oxobut-2-en-2-yl)amino]-3-phenylpropanoic acid?
You can request a quote for (2S)-2-[(4-ethoxy-4-oxobut-2-en-2-yl)amino]-3-phenylpropanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S)-2-[(4-ethoxy-4-oxobut-2-en-2-yl)amino]-3-phenylpropanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (2S)-2-[(4-ethoxy-4-oxobut-2-en-2-yl)amino]-3-phenylpropanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.