2-cyano-3-{4-[3-(2,3-dimethylphenoxy)propoxy]phenyl}-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Chemical Structure Depiction of
2-cyano-3-{4-[3-(2,3-dimethylphenoxy)propoxy]phenyl}-N~1~-(5-methyl-3-isoxazolyl)acrylamide
2-cyano-3-{4-[3-(2,3-dimethylphenoxy)propoxy]phenyl}-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Compound characteristics
| Compound ID: | C482-0458 |
| Compound Name: | 2-cyano-3-{4-[3-(2,3-dimethylphenoxy)propoxy]phenyl}-N~1~-(5-methyl-3-isoxazolyl)acrylamide |
| Molecular Weight: | 431.49 |
| Molecular Formula: | C25 H25 N3 O4 |
| Smiles: | Cc1cccc(c1C)OCCCOc1ccc(/C=C(/C#N)C(Nc2cc(C)on2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.84 |
| logD: | 4.32 |
| logSw: | -6.45 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 159.28 |
| InChI Key: | ZMAQJDOLCNRHQS-UHFFFAOYSA-N |