2-cyano-3-(2,5-dimethoxyphenyl)-N~1~-(4-phenyl-1,3-thiazol-2-yl)acrylamide
Chemical Structure Depiction of
2-cyano-3-(2,5-dimethoxyphenyl)-N~1~-(4-phenyl-1,3-thiazol-2-yl)acrylamide
2-cyano-3-(2,5-dimethoxyphenyl)-N~1~-(4-phenyl-1,3-thiazol-2-yl)acrylamide
Compound characteristics
Compound ID: | 4384-0003 |
Compound Name: | 2-cyano-3-(2,5-dimethoxyphenyl)-N~1~-(4-phenyl-1,3-thiazol-2-yl)acrylamide |
Molecular Weight: | 391.45 |
Molecular Formula: | C21 H17 N3 O3 S |
Smiles: | COc1ccc(c(/C=C(/C#N)C(Nc2nc(cs2)c2ccccc2)=O)c1)OC |
Stereo: | ACHIRAL |
logP: | 5.12 |
logD: | 5.11 |
logSw: | -6.25 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 113.77 |
InChI Key: | GJHWVYMLGMZTLQ-UHFFFAOYSA-N |