N-{5-[(3-chlorophenyl)methyl]-1,3-thiazol-2-yl}-2-cyano-3-(4-methylphenyl)prop-2-enamide
Chemical Structure Depiction of
N-{5-[(3-chlorophenyl)methyl]-1,3-thiazol-2-yl}-2-cyano-3-(4-methylphenyl)prop-2-enamide
N-{5-[(3-chlorophenyl)methyl]-1,3-thiazol-2-yl}-2-cyano-3-(4-methylphenyl)prop-2-enamide
Compound characteristics
| Compound ID: | 3643-0298 |
| Compound Name: | N-{5-[(3-chlorophenyl)methyl]-1,3-thiazol-2-yl}-2-cyano-3-(4-methylphenyl)prop-2-enamide |
| Molecular Weight: | 393.89 |
| Molecular Formula: | C21 H16 Cl N3 O S |
| Smiles: | Cc1ccc(\C=C(/C#N)C(Nc2ncc(Cc3cccc(c3)[Cl])s2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.1184 |
| logD: | 5.6074 |
| logSw: | -6.313 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.682 |
| InChI Key: | HZDBWLZGGNIDPE-UHFFFAOYSA-N |