2-cyano-3-[4-(diethylamino)phenyl]-N~1~-[5-(4-methylpiperidino)-1,3,4-thiadiazol-2-yl]acrylamide
Chemical Structure Depiction of
2-cyano-3-[4-(diethylamino)phenyl]-N~1~-[5-(4-methylpiperidino)-1,3,4-thiadiazol-2-yl]acrylamide
2-cyano-3-[4-(diethylamino)phenyl]-N~1~-[5-(4-methylpiperidino)-1,3,4-thiadiazol-2-yl]acrylamide
Compound characteristics
| Compound ID: | C726-2586 |
| Compound Name: | 2-cyano-3-[4-(diethylamino)phenyl]-N~1~-[5-(4-methylpiperidino)-1,3,4-thiadiazol-2-yl]acrylamide |
| Molecular Weight: | 424.57 |
| Molecular Formula: | C22 H28 N6 O S |
| Smiles: | CCN(CC)c1ccc(/C=C(/C#N)C(Nc2nnc(N3CCC(C)CC3)s2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.97 |
| logD: | 4.8 |
| logSw: | -5.73 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 139.21 |
| InChI Key: | YYSGSWWMWQQJRV-UHFFFAOYSA-N |