2-cyano-3-(2,5-dimethoxyphenyl)-N~1~-(5-isopropyl-1,3,4-thiadiazol-2-yl)acrylamide
Chemical Structure Depiction of
2-cyano-3-(2,5-dimethoxyphenyl)-N~1~-(5-isopropyl-1,3,4-thiadiazol-2-yl)acrylamide
2-cyano-3-(2,5-dimethoxyphenyl)-N~1~-(5-isopropyl-1,3,4-thiadiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | 3797-0052 |
| Compound Name: | 2-cyano-3-(2,5-dimethoxyphenyl)-N~1~-(5-isopropyl-1,3,4-thiadiazol-2-yl)acrylamide |
| Molecular Weight: | 358.42 |
| Molecular Formula: | C17 H18 N4 O3 S |
| Smiles: | CC(C)c1nnc(NC(C(=C/c2cc(ccc2OC)OC)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.69 |
| logD: | 2.07 |
| logSw: | -4.8 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 152.95 |
| InChI Key: | YHGATZIJVUVSOZ-UHFFFAOYSA-N |