Cinnamoylphenylalanin
TL;DR: Cinnamoylphenylalanin (CAS 4950-65-6) is a chemical compound with molecular formula C18H17NO3 and molecular weight 295.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-3-phenyl-2-(3-phenylprop-2-enoylamino)propanoic acid
Also Known As: Cinnamoylphenylalanin, Cinnamoyl-(trans)-L-phenylalanine, L-Phenylalanine, N-(1-oxo-3-phenyl-2-propenyl)-
| Molecular Formula | C18H17NO3 |
|---|---|
| Molecular Weight | 295.12 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 295.12085 |
| Heavy Atoms | 22 |
| Complexity | 393.0 |
Chemical Identifiers
| CAS Number | 4950-65-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)C[C@@H](C(=O)O)NC(=O)C=CC2=CC=CC=C2 |
| InChIKey | YFHVCODMDZNZEA-INIZCTEOSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cinnamoylphenylalanin (CAS 4950-65-6), with molecular formula C18H17NO3 and molecular weight 295.12 g/mol. IUPAC: (2S)-3-phenyl-2-(3-phenylprop-2-enoylamino)propanoic acid.
Chemical Property Profile of Cinnamoylphenylalanin
Property Insights of Cinnamoylphenylalanin
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cinnamoylphenylalanin. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Cinnamoylphenylalanin. Following Lipinski's Rule of Five, Cinnamoylphenylalanin has 2 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 Cinnamoylphenylalanin?
The CAS number of Cinnamoylphenylalanin is 4950-65-6.
What is the molecular formula of Cinnamoylphenylalanin?
The molecular formula of Cinnamoylphenylalanin is C18H17NO3.
What is the molecular weight of Cinnamoylphenylalanin?
The molecular weight of Cinnamoylphenylalanin is 295.12 g/mol.
Where can I buy Cinnamoylphenylalanin?
You can request a quote for Cinnamoylphenylalanin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cinnamoylphenylalanin?
Yes, KEHONG BIO provides custom synthesis services for Cinnamoylphenylalanin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.