(E)-N-benzyl-3-(2-chloro-6-fluorophenyl)prop-2-enamide
TL;DR: (E)-N-benzyl-3-(2-chloro-6-fluorophenyl)prop-2-enamide (CAS 1351483-79-8) is a chemical compound with molecular formula C16H13ClFNO and molecular weight 289.06696 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-N-benzyl-3-(2-chloro-6-fluorophenyl)prop-2-enamide
Also Known As: (E)-N-benzyl-3-(2-chloro-6-fluorophenyl)prop-2-enamide, (2E)-3-(6-chloro-2-fluorophenyl)-N-benzylprop-2-enamide, (2E)-N-benzyl-3-(2-chloro-6-fluorophenyl)prop-2-enamide
Technical Specifications
| Molecular Formula | C16H13ClFNO |
| Molecular Weight | 289.06696 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 289.06696 Da |
| Heavy Atoms | 20 |
| Complexity | 341.0 |
| SMILES | C1=CC=C(C=C1)CNC(=O)/C=C/C2=C(C=CC=C2Cl)F |
| InChIKey | SKSNONKMDVGLHE-MDZDMXLPSA-N |
Chemical Property Profile of (E)-N-benzyl-3-(2-chloro-6-fluorophenyl)prop-2-enamide
Property Insights of (E)-N-benzyl-3-(2-chloro-6-fluorophenyl)prop-2-enamide
The XLogP value of 3.8 indicates that (E)-N-benzyl-3-(2-chloro-6-fluorophenyl)prop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, (E)-N-benzyl-3-(2-chloro-6-fluorophenyl)prop-2-enamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-N-benzyl-3-(2-chloro-6-fluorophenyl)prop-2-enamide has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (E)-N-benzyl-3-(2-chloro-6-fluorophenyl)prop-2-enamide?
The CAS number of (E)-N-benzyl-3-(2-chloro-6-fluorophenyl)prop-2-enamide is 1351483-79-8.
What is the molecular formula of (E)-N-benzyl-3-(2-chloro-6-fluorophenyl)prop-2-enamide?
The molecular formula of (E)-N-benzyl-3-(2-chloro-6-fluorophenyl)prop-2-enamide is C16H13ClFNO.
What is the molecular weight of (E)-N-benzyl-3-(2-chloro-6-fluorophenyl)prop-2-enamide?
The molecular weight of (E)-N-benzyl-3-(2-chloro-6-fluorophenyl)prop-2-enamide is 289.06696 g/mol.
Where can I buy (E)-N-benzyl-3-(2-chloro-6-fluorophenyl)prop-2-enamide?
You can request a quote for (E)-N-benzyl-3-(2-chloro-6-fluorophenyl)prop-2-enamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (E)-N-benzyl-3-(2-chloro-6-fluorophenyl)prop-2-enamide?
Yes, CoreyChem provides custom synthesis services for (E)-N-benzyl-3-(2-chloro-6-fluorophenyl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.