4-[(2,4-dimethoxyphenyl)methylidene]-5-ethoxy-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-[(2,4-dimethoxyphenyl)methylidene]-5-ethoxy-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
4-[(2,4-dimethoxyphenyl)methylidene]-5-ethoxy-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 2339-2161 |
| Compound Name: | 4-[(2,4-dimethoxyphenyl)methylidene]-5-ethoxy-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 397.39 |
| Molecular Formula: | C20 H19 N3 O6 |
| Smiles: | CCOC1/C(=C/c2ccc(cc2OC)OC)C(N(c2ccc(cc2)[N+]([O-])=O)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6714 |
| logD: | 3.6714 |
| logSw: | -4.0197 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 83.121 |
| InChI Key: | MMQKRWGVTILYKV-UHFFFAOYSA-N |