TL;DR: 2-Cyano-3-(3-phenoxyphenyl)acrylamide (CAS 109314-45-6) is a chemical compound with molecular formula C16H12N2O2 and molecular weight 264.08987 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-2-cyano-3-(3-phenoxyphenyl)prop-2-enamide
Also Known As: 2-Cyano-3-(3-phenoxyphenyl)acrylamide, (2E)-2-cyano-3-(3-phenoxyphenyl)prop-2-enamide, 2-cyano-3-(3-phenoxyphenyl)prop-2-enamide, 3-(3-Phenoxyphenyl)-2-cyanopropeneamide, (E)-2-cyano-3-(3-phenoxyphenyl)prop-2-enamide
| Molecular Formula | C16H12N2O2 |
| Molecular Weight | 264.08987 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 76.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 264.08987 Da |
| Heavy Atoms | 20 |
| Complexity | 415.0 |
| SMILES | C1=CC=C(C=C1)OC2=CC=CC(=C2)/C=C(\C#N)/C(=O)N |
| InChIKey | SJOFTAHNDSJAQA-UKTHLTGXSA-N |
The XLogP value of 3.1 indicates that 2-Cyano-3-(3-phenoxyphenyl)acrylamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Cyano-3-(3-phenoxyphenyl)acrylamide. Following Lipinski's Rule of Five, 2-Cyano-3-(3-phenoxyphenyl)acrylamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-Cyano-3-(3-phenoxyphenyl)acrylamide is 109314-45-6.
The molecular formula of 2-Cyano-3-(3-phenoxyphenyl)acrylamide is C16H12N2O2.
The molecular weight of 2-Cyano-3-(3-phenoxyphenyl)acrylamide is 264.08987 g/mol.
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