2-cyano-3-[4-(dimethylamino)phenyl]-N~1~-(5-isobutyl-1,3,4-thiadiazol-2-yl)acrylamide
Chemical Structure Depiction of
2-cyano-3-[4-(dimethylamino)phenyl]-N~1~-(5-isobutyl-1,3,4-thiadiazol-2-yl)acrylamide
2-cyano-3-[4-(dimethylamino)phenyl]-N~1~-(5-isobutyl-1,3,4-thiadiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | 4277-0023 |
| Compound Name: | 2-cyano-3-[4-(dimethylamino)phenyl]-N~1~-(5-isobutyl-1,3,4-thiadiazol-2-yl)acrylamide |
| Molecular Weight: | 355.46 |
| Molecular Formula: | C18 H21 N5 O S |
| Smiles: | CC(C)Cc1nnc(NC(C(=C/c2ccc(cc2)N(C)C)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.18 |
| logD: | 2.25 |
| logSw: | -5.23 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 139.31 |
| InChI Key: | RUVGFSAIHRABCM-UHFFFAOYSA-N |