3-{3-allyl-5-methoxy-4-[(4-methylbenzyl)oxy]phenyl}-2-cyano-N~1~-(1,3-thiazol-2-yl)acrylamide
Chemical Structure Depiction of
3-{3-allyl-5-methoxy-4-[(4-methylbenzyl)oxy]phenyl}-2-cyano-N~1~-(1,3-thiazol-2-yl)acrylamide
3-{3-allyl-5-methoxy-4-[(4-methylbenzyl)oxy]phenyl}-2-cyano-N~1~-(1,3-thiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | 5253-0140 |
| Compound Name: | 3-{3-allyl-5-methoxy-4-[(4-methylbenzyl)oxy]phenyl}-2-cyano-N~1~-(1,3-thiazol-2-yl)acrylamide |
| Molecular Weight: | 445.54 |
| Molecular Formula: | C25 H23 N3 O3 S |
| Smiles: | Cc1ccc(COc2c(CC=C)cc(/C=C(/C#N)C(Nc3nccs3)=O)cc2OC)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.7 |
| logD: | 5.43 |
| logSw: | -6.6 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 114.1 |
| InChI Key: | IXWCFDWIQRSESX-UHFFFAOYSA-N |