2-cyano-3-[4-(methylsulfanyl)phenyl]-N~1~-(4-phenyl-1,3-thiazol-2-yl)acrylamide
Chemical Structure Depiction of
2-cyano-3-[4-(methylsulfanyl)phenyl]-N~1~-(4-phenyl-1,3-thiazol-2-yl)acrylamide
2-cyano-3-[4-(methylsulfanyl)phenyl]-N~1~-(4-phenyl-1,3-thiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | 4384-0758 |
| Compound Name: | 2-cyano-3-[4-(methylsulfanyl)phenyl]-N~1~-(4-phenyl-1,3-thiazol-2-yl)acrylamide |
| Molecular Weight: | 377.49 |
| Molecular Formula: | C20 H15 N3 O S2 |
| Smiles: | CSc1ccc(/C=C(/C#N)C(Nc2nc(cs2)c2ccccc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.78 |
| logD: | 5.77 |
| logSw: | -6.58 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 145.45 |
| InChI Key: | PDJSMHRJHPVHNT-UHFFFAOYSA-N |