4-(2,5-dimethoxyphenyl)-2-hydroxy-N-(2-methyl-3-nitrophenyl)-4-oxobut-2-enamide
Chemical Structure Depiction of
4-(2,5-dimethoxyphenyl)-2-hydroxy-N-(2-methyl-3-nitrophenyl)-4-oxobut-2-enamide
4-(2,5-dimethoxyphenyl)-2-hydroxy-N-(2-methyl-3-nitrophenyl)-4-oxobut-2-enamide
Compound characteristics
| Compound ID: | C301-0530 |
| Compound Name: | 4-(2,5-dimethoxyphenyl)-2-hydroxy-N-(2-methyl-3-nitrophenyl)-4-oxobut-2-enamide |
| Molecular Weight: | 386.36 |
| Molecular Formula: | C19 H18 N2 O7 |
| Smiles: | Cc1c(cccc1[N+]([O-])=O)NC(/C(=C/C(c1cc(ccc1OC)OC)=O)O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7938 |
| logD: | 2.4598 |
| logSw: | -3.5507 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.695 |
| InChI Key: | YYKGPXDVJRVKLR-UHFFFAOYSA-N |