2-cyano-3-{4-[3-(2,5-dimethylphenoxy)propoxy]phenyl}-N~1~-(1,3-thiazol-2-yl)acrylamide
Chemical Structure Depiction of
2-cyano-3-{4-[3-(2,5-dimethylphenoxy)propoxy]phenyl}-N~1~-(1,3-thiazol-2-yl)acrylamide
2-cyano-3-{4-[3-(2,5-dimethylphenoxy)propoxy]phenyl}-N~1~-(1,3-thiazol-2-yl)acrylamide
Compound characteristics
Compound ID: | 5091-0987 |
Compound Name: | 2-cyano-3-{4-[3-(2,5-dimethylphenoxy)propoxy]phenyl}-N~1~-(1,3-thiazol-2-yl)acrylamide |
Molecular Weight: | 433.53 |
Molecular Formula: | C24 H23 N3 O3 S |
Smiles: | Cc1ccc(C)c(c1)OCCCOc1ccc(/C=C(/C#N)C(Nc2nccs2)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 5.61 |
logD: | 5.34 |
logSw: | -6.2 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 122.73 |
InChI Key: | WNNGJPZFTCNZRW-UHFFFAOYSA-N |