4-(2,5-dimethoxyphenyl)-2-hydroxy-N-(2-methoxy-4-nitrophenyl)-4-oxobut-2-enamide
Chemical Structure Depiction of
4-(2,5-dimethoxyphenyl)-2-hydroxy-N-(2-methoxy-4-nitrophenyl)-4-oxobut-2-enamide
4-(2,5-dimethoxyphenyl)-2-hydroxy-N-(2-methoxy-4-nitrophenyl)-4-oxobut-2-enamide
Compound characteristics
| Compound ID: | C301-0531 |
| Compound Name: | 4-(2,5-dimethoxyphenyl)-2-hydroxy-N-(2-methoxy-4-nitrophenyl)-4-oxobut-2-enamide |
| Molecular Weight: | 402.36 |
| Molecular Formula: | C19 H18 N2 O8 |
| Smiles: | COc1ccc(c(c1)C(/C=C(/C(Nc1ccc(cc1OC)[N+]([O-])=O)=O)O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.6718 |
| logD: | 1.0789 |
| logSw: | -3.331 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 107.626 |
| InChI Key: | TVVITFLEZPTQPR-UHFFFAOYSA-N |