N-[(3-chlorophenyl)methyl]-2-cyano-3-(2-methoxynaphthalen-1-yl)prop-2-enamide
Chemical Structure Depiction of
N-[(3-chlorophenyl)methyl]-2-cyano-3-(2-methoxynaphthalen-1-yl)prop-2-enamide
N-[(3-chlorophenyl)methyl]-2-cyano-3-(2-methoxynaphthalen-1-yl)prop-2-enamide
Compound characteristics
| Compound ID: | K781-0699 |
| Compound Name: | N-[(3-chlorophenyl)methyl]-2-cyano-3-(2-methoxynaphthalen-1-yl)prop-2-enamide |
| Molecular Weight: | 376.84 |
| Molecular Formula: | C22 H17 Cl N2 O2 |
| Smiles: | COc1ccc2ccccc2c1\C=C(/C#N)C(NCc1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.7439 |
| logD: | 4.7434 |
| logSw: | -5.2009 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.067 |
| InChI Key: | SHFUWSWSEOSFDS-UHFFFAOYSA-N |