4-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
4-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 4302-2477 |
| Compound Name: | 4-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 475.46 |
| Molecular Formula: | C25 H21 N3 O7 |
| Smiles: | COc1ccc(cc1)C1/C(=C/c2cc(c(c(c2)OC)O)OC)C(N(c2ccc(cc2)[N+]([O-])=O)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7633 |
| logD: | 3.7532 |
| logSw: | -4.0652 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.807 |
| InChI Key: | BDLUUPHDFZZGLJ-UHFFFAOYSA-N |