3-{3-chloro-4-[3-(3-methylphenoxy)propoxy]phenyl}-2-cyano-N~1~-(1,3-thiazol-2-yl)acrylamide
Chemical Structure Depiction of
3-{3-chloro-4-[3-(3-methylphenoxy)propoxy]phenyl}-2-cyano-N~1~-(1,3-thiazol-2-yl)acrylamide
3-{3-chloro-4-[3-(3-methylphenoxy)propoxy]phenyl}-2-cyano-N~1~-(1,3-thiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | 5253-0202 |
| Compound Name: | 3-{3-chloro-4-[3-(3-methylphenoxy)propoxy]phenyl}-2-cyano-N~1~-(1,3-thiazol-2-yl)acrylamide |
| Molecular Weight: | 453.95 |
| Molecular Formula: | C23 H20 Cl N3 O3 S |
| Smiles: | Cc1cccc(c1)OCCCOc1ccc(/C=C(/C#N)C(Nc2nccs2)=O)cc1[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.72 |
| logD: | 5.44 |
| logSw: | -6.49 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 114.35 |
| InChI Key: | JAUNDZMBGYAAPP-UHFFFAOYSA-N |