2-cyano-3-[4-(dimethylamino)phenyl]-N~1~-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]acrylamide
Chemical Structure Depiction of
2-cyano-3-[4-(dimethylamino)phenyl]-N~1~-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]acrylamide
2-cyano-3-[4-(dimethylamino)phenyl]-N~1~-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]acrylamide
Compound characteristics
| Compound ID: | 4011-0050 |
| Compound Name: | 2-cyano-3-[4-(dimethylamino)phenyl]-N~1~-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]acrylamide |
| Molecular Weight: | 389.48 |
| Molecular Formula: | C21 H19 N5 O S |
| Smiles: | Cc1ccc(cc1)c1nnc(NC(C(=C/c2ccc(cc2)N(C)C)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.87 |
| logD: | 4.78 |
| logSw: | -5.76 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 137.96 |
| InChI Key: | WJQAVSHVIGQCMC-UHFFFAOYSA-N |