2-cyano-3-(3-fluorophenyl)-N-(2-phenylethyl)prop-2-enamide
TL;DR: 2-cyano-3-(3-fluorophenyl)-N-(2-phenylethyl)prop-2-enamide (CAS 309944-19-2) is a chemical compound with molecular formula C18H15FN2O and molecular weight 294.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-cyano-3-(3-fluorophenyl)-N-(2-phenylethyl)prop-2-enamide
Also Known As: (E)-2-cyano-3-(3-fluorophenyl)-N-phenethylprop-2-enamide, 2-cyano-3-(3-fluorophenyl)-N-(2-phenylethyl)prop-2-enamide
| Molecular Formula | C18H15FN2O |
|---|---|
| Molecular Weight | 294.12 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 52.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 294.11685 |
| Heavy Atoms | 22 |
| Complexity | 445.0 |
Chemical Identifiers
| CAS Number | 309944-19-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCNC(=O)/C(=C/C2=CC(=CC=C2)F)/C#N |
| InChIKey | OUVIZCIDMRKSRB-LFIBNONCSA-N |
Product Overview
2-cyano-3-(3-fluorophenyl)-N-(2-phenylethyl)prop-2-enamide (CAS 309944-19-2), with molecular formula C18H15FN2O and molecular weight 294.12 g/mol. IUPAC: (E)-2-cyano-3-(3-fluorophenyl)-N-(2-phenylethyl)prop-2-enamide.
Chemical Property Profile of 2-cyano-3-(3-fluorophenyl)-N-(2-phenylethyl)prop-2-enamide
Property Insights of 2-cyano-3-(3-fluorophenyl)-N-(2-phenylethyl)prop-2-enamide
The XLogP value of 3.6 indicates that 2-cyano-3-(3-fluorophenyl)-N-(2-phenylethyl)prop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.9 Ų, 2-cyano-3-(3-fluorophenyl)-N-(2-phenylethyl)prop-2-enamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-cyano-3-(3-fluorophenyl)-N-(2-phenylethyl)prop-2-enamide 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 2-cyano-3-(3-fluorophenyl)-N-(2-phenylethyl)prop-2-enamide?
The CAS number of 2-cyano-3-(3-fluorophenyl)-N-(2-phenylethyl)prop-2-enamide is 309944-19-2.
What is the molecular formula of 2-cyano-3-(3-fluorophenyl)-N-(2-phenylethyl)prop-2-enamide?
The molecular formula of 2-cyano-3-(3-fluorophenyl)-N-(2-phenylethyl)prop-2-enamide is C18H15FN2O.
What is the molecular weight of 2-cyano-3-(3-fluorophenyl)-N-(2-phenylethyl)prop-2-enamide?
The molecular weight of 2-cyano-3-(3-fluorophenyl)-N-(2-phenylethyl)prop-2-enamide is 294.12 g/mol.
Where can I buy 2-cyano-3-(3-fluorophenyl)-N-(2-phenylethyl)prop-2-enamide?
You can request a quote for 2-cyano-3-(3-fluorophenyl)-N-(2-phenylethyl)prop-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-cyano-3-(3-fluorophenyl)-N-(2-phenylethyl)prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for 2-cyano-3-(3-fluorophenyl)-N-(2-phenylethyl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.