3-[3-bromo-4-(3-phenoxypropoxy)phenyl]-2-cyano-N~1~-(1,3-thiazol-2-yl)acrylamide
Chemical Structure Depiction of
3-[3-bromo-4-(3-phenoxypropoxy)phenyl]-2-cyano-N~1~-(1,3-thiazol-2-yl)acrylamide
3-[3-bromo-4-(3-phenoxypropoxy)phenyl]-2-cyano-N~1~-(1,3-thiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | 5253-0661 |
| Compound Name: | 3-[3-bromo-4-(3-phenoxypropoxy)phenyl]-2-cyano-N~1~-(1,3-thiazol-2-yl)acrylamide |
| Molecular Weight: | 484.37 |
| Molecular Formula: | C22 H18 Br N3 O3 S |
| Smiles: | C(COc1ccccc1)COc1ccc(/C=C(/C#N)C(Nc2nccs2)=O)cc1[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.16 |
| logD: | 4.89 |
| logSw: | -6.05 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 121.99 |
| InChI Key: | DSARYSUACPCRMD-UHFFFAOYSA-N |