2-cyano-N~1~-(5-isobutyl-1,3,4-thiadiazol-2-yl)-3-(4-methylphenyl)acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-(5-isobutyl-1,3,4-thiadiazol-2-yl)-3-(4-methylphenyl)acrylamide
2-cyano-N~1~-(5-isobutyl-1,3,4-thiadiazol-2-yl)-3-(4-methylphenyl)acrylamide
Compound characteristics
| Compound ID: | 4277-0006 |
| Compound Name: | 2-cyano-N~1~-(5-isobutyl-1,3,4-thiadiazol-2-yl)-3-(4-methylphenyl)acrylamide |
| Molecular Weight: | 326.42 |
| Molecular Formula: | C17 H18 N4 O S |
| Smiles: | CC(C)Cc1nnc(NC(C(=C/c2ccc(C)cc2)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.51 |
| logD: | 2.58 |
| logSw: | -5.2 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 140.68 |
| InChI Key: | RYGWHMCRFRTTTA-UHFFFAOYSA-N |