2-cyano-3-(4-hydroxy-3,5-dimethoxyphenyl)-N~1~-[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]acrylamide
Chemical Structure Depiction of
2-cyano-3-(4-hydroxy-3,5-dimethoxyphenyl)-N~1~-[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]acrylamide
2-cyano-3-(4-hydroxy-3,5-dimethoxyphenyl)-N~1~-[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]acrylamide
Compound characteristics
| Compound ID: | C146-0539 |
| Compound Name: | 2-cyano-3-(4-hydroxy-3,5-dimethoxyphenyl)-N~1~-[3-(methylsulfanyl)-1,2,4-thiadiazol-5-yl]acrylamide |
| Molecular Weight: | 378.43 |
| Molecular Formula: | C15 H14 N4 O4 S2 |
| Smiles: | COc1cc(/C=C(/C#N)C(Nc2nc(ns2)SC)=O)cc(c1O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.57 |
| logD: | 1.89 |
| logSw: | -3.34 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 233.49 |
| InChI Key: | GWILMLOFDGSWFW-UHFFFAOYSA-N |