2-cyano-3-{3-methoxy-4-[(2-methylbenzyl)oxy]phenyl}-N~1~-(4-phenyl-1,3-thiazol-2-yl)acrylamide
Chemical Structure Depiction of
2-cyano-3-{3-methoxy-4-[(2-methylbenzyl)oxy]phenyl}-N~1~-(4-phenyl-1,3-thiazol-2-yl)acrylamide
2-cyano-3-{3-methoxy-4-[(2-methylbenzyl)oxy]phenyl}-N~1~-(4-phenyl-1,3-thiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | 4384-0626 |
| Compound Name: | 2-cyano-3-{3-methoxy-4-[(2-methylbenzyl)oxy]phenyl}-N~1~-(4-phenyl-1,3-thiazol-2-yl)acrylamide |
| Molecular Weight: | 481.57 |
| Molecular Formula: | C28 H23 N3 O3 S |
| Smiles: | Cc1ccccc1COc1ccc(/C=C(/C#N)C(Nc2nc(cs2)c2ccccc2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 6.78 |
| logD: | 6.77 |
| logSw: | -7.57 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 116.03 |
| InChI Key: | LYMMVRQSXVIBPQ-UHFFFAOYSA-N |