2-cyano-N~1~-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-3-[4-(diethylamino)phenyl]acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-3-[4-(diethylamino)phenyl]acrylamide
2-cyano-N~1~-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-3-[4-(diethylamino)phenyl]acrylamide
Compound characteristics
| Compound ID: | 4011-0083 |
| Compound Name: | 2-cyano-N~1~-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-3-[4-(diethylamino)phenyl]acrylamide |
| Molecular Weight: | 409.55 |
| Molecular Formula: | C22 H27 N5 O S |
| Smiles: | CCN(CC)c1ccc(/C=C(/C#N)C(Nc2nnc(C3CCCCC3)s2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.43 |
| logD: | 3.52 |
| logSw: | -6.01 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 134.26 |
| InChI Key: | BJFYGMNHKHKHMN-UHFFFAOYSA-N |