2-(4-chlorophenyl)-5-methyl-4-[(2-nitrophenyl)methylidene]-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
2-(4-chlorophenyl)-5-methyl-4-[(2-nitrophenyl)methylidene]-2,4-dihydro-3H-pyrazol-3-one
2-(4-chlorophenyl)-5-methyl-4-[(2-nitrophenyl)methylidene]-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 8004-8547 |
| Compound Name: | 2-(4-chlorophenyl)-5-methyl-4-[(2-nitrophenyl)methylidene]-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 341.75 |
| Molecular Formula: | C17 H12 Cl N3 O3 |
| Smiles: | CC1/C(=C\c2ccccc2[N+]([O-])=O)C(N(c2ccc(cc2)[Cl])N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8585 |
| logD: | 3.8585 |
| logSw: | -4.3488 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.667 |
| InChI Key: | RAFPITJPDDTFLH-UHFFFAOYSA-N |