4-[2-(2,6-dichloro-4-nitrophenyl)hydrazinylidene]-2-(4-nitrophenyl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-[2-(2,6-dichloro-4-nitrophenyl)hydrazinylidene]-2-(4-nitrophenyl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one
4-[2-(2,6-dichloro-4-nitrophenyl)hydrazinylidene]-2-(4-nitrophenyl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 1652-2244 |
| Compound Name: | 4-[2-(2,6-dichloro-4-nitrophenyl)hydrazinylidene]-2-(4-nitrophenyl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 499.27 |
| Molecular Formula: | C21 H12 Cl2 N6 O5 |
| Smiles: | c1ccc(cc1)C1/C(C(N(c2ccc(cc2)[N+]([O-])=O)N=1)=O)=N/Nc1c(cc(cc1[Cl])[N+]([O-])=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.2952 |
| logD: | 5.1758 |
| logSw: | -6.0418 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 111.484 |
| InChI Key: | WAJGMDFUYQUYHN-UHFFFAOYSA-N |