2-cyano-3-(3,4-dimethoxyphenyl)-N~1~-(5-piperidino-1,3,4-thiadiazol-2-yl)acrylamide
Chemical Structure Depiction of
2-cyano-3-(3,4-dimethoxyphenyl)-N~1~-(5-piperidino-1,3,4-thiadiazol-2-yl)acrylamide
2-cyano-3-(3,4-dimethoxyphenyl)-N~1~-(5-piperidino-1,3,4-thiadiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | C726-0949 |
| Compound Name: | 2-cyano-3-(3,4-dimethoxyphenyl)-N~1~-(5-piperidino-1,3,4-thiadiazol-2-yl)acrylamide |
| Molecular Weight: | 399.47 |
| Molecular Formula: | C19 H21 N5 O3 S |
| Smiles: | COc1ccc(/C=C(/C#N)C(Nc2nnc(N3CCCCC3)s2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.43 |
| logD: | 3.27 |
| logSw: | -4.15 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 168.08 |
| InChI Key: | FVYANKNMYKBSPS-UHFFFAOYSA-N |