4-[(2,4-dichloro-5-nitrophenyl)methylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-[(2,4-dichloro-5-nitrophenyl)methylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
4-[(2,4-dichloro-5-nitrophenyl)methylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 2082-0286 |
| Compound Name: | 4-[(2,4-dichloro-5-nitrophenyl)methylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 376.2 |
| Molecular Formula: | C17 H11 Cl2 N3 O3 |
| Smiles: | CC1/C(=C/c2cc(c(cc2[Cl])[Cl])[N+]([O-])=O)C(N(c2ccccc2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4674 |
| logD: | 4.4674 |
| logSw: | -4.6972 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.667 |
| InChI Key: | OCWQWKIINKAYQX-UHFFFAOYSA-N |