3-(1,3-benzodioxol-5-yl)-2-cyano-N~1~-(4-phenyl-1,3-thiazol-2-yl)acrylamide
Chemical Structure Depiction of
3-(1,3-benzodioxol-5-yl)-2-cyano-N~1~-(4-phenyl-1,3-thiazol-2-yl)acrylamide
3-(1,3-benzodioxol-5-yl)-2-cyano-N~1~-(4-phenyl-1,3-thiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | 4384-0075 |
| Compound Name: | 3-(1,3-benzodioxol-5-yl)-2-cyano-N~1~-(4-phenyl-1,3-thiazol-2-yl)acrylamide |
| Molecular Weight: | 375.4 |
| Molecular Formula: | C20 H13 N3 O3 S |
| Smiles: | C1Oc2ccc(/C=C(/C#N)C(Nc3nc(cs3)c3ccccc3)=O)cc2O1 |
| Stereo: | ACHIRAL |
| logP: | 4.96 |
| logD: | 4.95 |
| logSw: | -5.7 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 140.41 |
| InChI Key: | MGZYZABVNABUIW-UHFFFAOYSA-N |