4-[(3-hydroxy-4-methoxyphenyl)methylidene]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-[(3-hydroxy-4-methoxyphenyl)methylidene]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
4-[(3-hydroxy-4-methoxyphenyl)methylidene]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 4302-2478 |
| Compound Name: | 4-[(3-hydroxy-4-methoxyphenyl)methylidene]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 445.43 |
| Molecular Formula: | C24 H19 N3 O6 |
| Smiles: | COc1ccc(cc1)C1/C(=C/c2ccc(c(c2)O)OC)C(N(c2ccc(cc2)[N+]([O-])=O)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0552 |
| logD: | 4.0514 |
| logSw: | -3.992 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.246 |
| InChI Key: | FTLFFLGUNHPJEK-UHFFFAOYSA-N |