3-[3-bromo-4-(2-phenoxyethoxy)phenyl]-2-cyano-N~1~-(1,3-thiazol-2-yl)acrylamide
Chemical Structure Depiction of
3-[3-bromo-4-(2-phenoxyethoxy)phenyl]-2-cyano-N~1~-(1,3-thiazol-2-yl)acrylamide
3-[3-bromo-4-(2-phenoxyethoxy)phenyl]-2-cyano-N~1~-(1,3-thiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | 5253-0410 |
| Compound Name: | 3-[3-bromo-4-(2-phenoxyethoxy)phenyl]-2-cyano-N~1~-(1,3-thiazol-2-yl)acrylamide |
| Molecular Weight: | 470.34 |
| Molecular Formula: | C21 H16 Br N3 O3 S |
| Smiles: | C(COc1ccc(/C=C(/C#N)C(Nc2nccs2)=O)cc1[Br])Oc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.69 |
| logD: | 4.42 |
| logSw: | -5.24 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 130.31 |
| InChI Key: | BZTKDMIANDHISH-UHFFFAOYSA-N |