2-cyano-3-(3,4-dimethoxyphenyl)-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Chemical Structure Depiction of
2-cyano-3-(3,4-dimethoxyphenyl)-N~1~-(5-methyl-3-isoxazolyl)acrylamide
2-cyano-3-(3,4-dimethoxyphenyl)-N~1~-(5-methyl-3-isoxazolyl)acrylamide
Compound characteristics
| Compound ID: | C482-0151 |
| Compound Name: | 2-cyano-3-(3,4-dimethoxyphenyl)-N~1~-(5-methyl-3-isoxazolyl)acrylamide |
| Molecular Weight: | 313.31 |
| Molecular Formula: | C16 H15 N3 O4 |
| Smiles: | Cc1cc(NC(C(=C/c2ccc(c(c2)OC)OC)\C#N)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 2.69 |
| logD: | 1.17 |
| logSw: | -3.73 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 174.98 |
| InChI Key: | XOVHEDSMYXOZMT-UHFFFAOYSA-N |