N-{5-[(3-chlorophenyl)methyl]-1,3-thiazol-2-yl}-2-cyano-3-phenylprop-2-enamide
Chemical Structure Depiction of
N-{5-[(3-chlorophenyl)methyl]-1,3-thiazol-2-yl}-2-cyano-3-phenylprop-2-enamide
N-{5-[(3-chlorophenyl)methyl]-1,3-thiazol-2-yl}-2-cyano-3-phenylprop-2-enamide
Compound characteristics
| Compound ID: | 3643-0297 |
| Compound Name: | N-{5-[(3-chlorophenyl)methyl]-1,3-thiazol-2-yl}-2-cyano-3-phenylprop-2-enamide |
| Molecular Weight: | 379.87 |
| Molecular Formula: | C20 H14 Cl N3 O S |
| Smiles: | C(c1cccc(c1)[Cl])c1cnc(NC(C(=C\c2ccccc2)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.6993 |
| logD: | 5.1883 |
| logSw: | -6.0074 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.682 |
| InChI Key: | XDELEMJXYFPSFK-UHFFFAOYSA-N |