2-cyano-3-[4-(propan-2-yl)phenyl]-N-[(pyridin-3-yl)methyl]prop-2-enamide
Chemical Structure Depiction of
2-cyano-3-[4-(propan-2-yl)phenyl]-N-[(pyridin-3-yl)methyl]prop-2-enamide
2-cyano-3-[4-(propan-2-yl)phenyl]-N-[(pyridin-3-yl)methyl]prop-2-enamide
Compound characteristics
| Compound ID: | 3236-0117 |
| Compound Name: | 2-cyano-3-[4-(propan-2-yl)phenyl]-N-[(pyridin-3-yl)methyl]prop-2-enamide |
| Molecular Weight: | 305.38 |
| Molecular Formula: | C19 H19 N3 O |
| Smiles: | CC(C)c1ccc(\C=C(/C#N)C(NCc2cccnc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.2277 |
| logD: | 3.2275 |
| logSw: | -3.1488 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.226 |
| InChI Key: | LCDOHYBDFVFXQF-UHFFFAOYSA-N |