N-(prop-2-en-1-ylcarbamoyl)-L-phenylalanine
TL;DR: N-(prop-2-en-1-ylcarbamoyl)-L-phenylalanine (CAS 1173671-52-7) is a chemical compound with molecular formula C13H16N2O3 and molecular weight 248.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-3-phenyl-2-(prop-2-enylcarbamoylamino)propanoic acid
Also Known As: N-(prop-2-en-1-ylcarbamoyl)-L-phenylalanine, (S)-2-(3-allylureido)-3-phenylpropanoic acid, 3-phenyl-2-(prop-2-enylcarbamoylamino)propanoic Acid, (2S)-3-phenyl-2-(prop-2-enylcarbamoylamino)propanoic acid
| Molecular Formula | C13H16N2O3 |
|---|---|
| Molecular Weight | 248.12 g/mol |
| LogP | 1.1675 |
| Topological Polar Surface Area | 78.43 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 248.11609 |
| Heavy Atoms | 18 |
| Complexity | 417.50436 |
Chemical Identifiers
| CAS Number | 1173671-52-7 |
|---|---|
| SMILES | C=CCNC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O |
Product Overview
N-(prop-2-en-1-ylcarbamoyl)-L-phenylalanine (CAS 1173671-52-7), with molecular formula C13H16N2O3 and molecular weight 248.12 g/mol. IUPAC: (2S)-3-phenyl-2-(prop-2-enylcarbamoylamino)propanoic acid.
Chemical Property Profile of N-(prop-2-en-1-ylcarbamoyl)-L-phenylalanine
Property Insights of N-(prop-2-en-1-ylcarbamoyl)-L-phenylalanine
The XLogP value of 1.1675 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(prop-2-en-1-ylcarbamoyl)-L-phenylalanine. The TPSA of 78.43 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(prop-2-en-1-ylcarbamoyl)-L-phenylalanine. Following Lipinski's Rule of Five, N-(prop-2-en-1-ylcarbamoyl)-L-phenylalanine has 3 hydrogen bond donor(s) and 2 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 N-(prop-2-en-1-ylcarbamoyl)-L-phenylalanine?
The CAS number of N-(prop-2-en-1-ylcarbamoyl)-L-phenylalanine is 1173671-52-7.
What is the molecular formula of N-(prop-2-en-1-ylcarbamoyl)-L-phenylalanine?
The molecular formula of N-(prop-2-en-1-ylcarbamoyl)-L-phenylalanine is C13H16N2O3.
What is the molecular weight of N-(prop-2-en-1-ylcarbamoyl)-L-phenylalanine?
The molecular weight of N-(prop-2-en-1-ylcarbamoyl)-L-phenylalanine is 248.12 g/mol.
Where can I buy N-(prop-2-en-1-ylcarbamoyl)-L-phenylalanine?
You can request a quote for N-(prop-2-en-1-ylcarbamoyl)-L-phenylalanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(prop-2-en-1-ylcarbamoyl)-L-phenylalanine?
Yes, KEHONG BIO provides custom synthesis services for N-(prop-2-en-1-ylcarbamoyl)-L-phenylalanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.