3-(3-chloro-4-ethoxy-5-methoxyphenyl)-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Chemical Structure Depiction of
3-(3-chloro-4-ethoxy-5-methoxyphenyl)-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide
3-(3-chloro-4-ethoxy-5-methoxyphenyl)-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Compound characteristics
| Compound ID: | C482-1008 |
| Compound Name: | 3-(3-chloro-4-ethoxy-5-methoxyphenyl)-2-cyano-N~1~-(5-methyl-3-isoxazolyl)acrylamide |
| Molecular Weight: | 361.78 |
| Molecular Formula: | C17 H16 Cl N3 O4 |
| Smiles: | CCOc1c(cc(/C=C(/C#N)C(Nc2cc(C)on2)=O)cc1[Cl])OC |
| Stereo: | ACHIRAL |
| logP: | 4.17 |
| logD: | 2.65 |
| logSw: | -5.01 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 159.84 |
| InChI Key: | AMURUFMPAXQACF-UHFFFAOYSA-N |