2-cyano-N~1~-(5-isobutyl-1,3,4-thiadiazol-2-yl)-3-(1-naphthyl)acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-(5-isobutyl-1,3,4-thiadiazol-2-yl)-3-(1-naphthyl)acrylamide
2-cyano-N~1~-(5-isobutyl-1,3,4-thiadiazol-2-yl)-3-(1-naphthyl)acrylamide
Compound characteristics
| Compound ID: | 4277-0029 |
| Compound Name: | 2-cyano-N~1~-(5-isobutyl-1,3,4-thiadiazol-2-yl)-3-(1-naphthyl)acrylamide |
| Molecular Weight: | 362.45 |
| Molecular Formula: | C20 H18 N4 O S |
| Smiles: | CC(C)Cc1nnc(NC(C(=C/c2cccc3ccccc23)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.1 |
| logD: | 2.76 |
| logSw: | -6.16 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 136.16 |
| InChI Key: | BOKNIPSCKRJWGL-UHFFFAOYSA-N |