N-[(3-chlorophenyl)methyl]-2-cyano-3-(2,3-dimethoxyphenyl)prop-2-enamide
Chemical Structure Depiction of
N-[(3-chlorophenyl)methyl]-2-cyano-3-(2,3-dimethoxyphenyl)prop-2-enamide
N-[(3-chlorophenyl)methyl]-2-cyano-3-(2,3-dimethoxyphenyl)prop-2-enamide
Compound characteristics
| Compound ID: | K781-0802 |
| Compound Name: | N-[(3-chlorophenyl)methyl]-2-cyano-3-(2,3-dimethoxyphenyl)prop-2-enamide |
| Molecular Weight: | 356.81 |
| Molecular Formula: | C19 H17 Cl N2 O3 |
| Smiles: | COc1cccc(\C=C(/C#N)C(NCc2cccc(c2)[Cl])=O)c1OC |
| Stereo: | ACHIRAL |
| logP: | 3.5652 |
| logD: | 3.565 |
| logSw: | -3.9309 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.056 |
| InChI Key: | QZMYKWNNANCGGA-UHFFFAOYSA-N |