2-cyano-3-{4-[3-(2,4-dimethylphenoxy)propoxy]phenyl}-N~1~-(1,3-thiazol-2-yl)acrylamide
Chemical Structure Depiction of
2-cyano-3-{4-[3-(2,4-dimethylphenoxy)propoxy]phenyl}-N~1~-(1,3-thiazol-2-yl)acrylamide
2-cyano-3-{4-[3-(2,4-dimethylphenoxy)propoxy]phenyl}-N~1~-(1,3-thiazol-2-yl)acrylamide
Compound characteristics
Compound ID: | 5091-0990 |
Compound Name: | 2-cyano-3-{4-[3-(2,4-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: | 5.81 |
logD: | 5.54 |
logSw: | -6.37 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 120.98 |
InChI Key: | YUQRRSBGDNXMQN-UHFFFAOYSA-N |