2-cyano-3-(4-ethylphenyl)-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Chemical Structure Depiction of
2-cyano-3-(4-ethylphenyl)-N~1~-(5-methyl-3-isoxazolyl)acrylamide
2-cyano-3-(4-ethylphenyl)-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Compound characteristics
| Compound ID: | C482-0411 |
| Compound Name: | 2-cyano-3-(4-ethylphenyl)-N~1~-(5-methyl-3-isoxazolyl)acrylamide |
| Molecular Weight: | 281.31 |
| Molecular Formula: | C16 H15 N3 O2 |
| Smiles: | CCc1ccc(/C=C(/C#N)C(Nc2cc(C)on2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.02 |
| logD: | 2.5 |
| logSw: | -4.85 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 152.03 |
| InChI Key: | XXSNYSNVMUQEFC-UHFFFAOYSA-N |