2-(3-chlorophenyl)-5-methyl-4-[(3-phenyl-1H-pyrazol-4-yl)methylidene]-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
2-(3-chlorophenyl)-5-methyl-4-[(3-phenyl-1H-pyrazol-4-yl)methylidene]-2,4-dihydro-3H-pyrazol-3-one
2-(3-chlorophenyl)-5-methyl-4-[(3-phenyl-1H-pyrazol-4-yl)methylidene]-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 2367-1331 |
| Compound Name: | 2-(3-chlorophenyl)-5-methyl-4-[(3-phenyl-1H-pyrazol-4-yl)methylidene]-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 362.82 |
| Molecular Formula: | C20 H15 Cl N4 O |
| Smiles: | CC1/C(=C\c2c[nH]nc2c2ccccc2)C(N(c2cccc(c2)[Cl])N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0739 |
| logD: | 4.0739 |
| logSw: | -4.3794 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.777 |
| InChI Key: | XXICKNQYJKLJSE-UHFFFAOYSA-N |