4-[(1,3-dimethyl-1H-pyrazol-4-yl)methylidene]-2,5-diphenyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-[(1,3-dimethyl-1H-pyrazol-4-yl)methylidene]-2,5-diphenyl-2,4-dihydro-3H-pyrazol-3-one
4-[(1,3-dimethyl-1H-pyrazol-4-yl)methylidene]-2,5-diphenyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | Y502-1024 |
| Compound Name: | 4-[(1,3-dimethyl-1H-pyrazol-4-yl)methylidene]-2,5-diphenyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 342.4 |
| Molecular Formula: | C21 H18 N4 O |
| Smiles: | Cc1c(\C=C2/C(c3ccccc3)=NN(C2=O)c2ccccc2)cn(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.8044 |
| logD: | 2.8044 |
| logSw: | -3.1313 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.304 |
| InChI Key: | PQHUVIRKYOCRNQ-UHFFFAOYSA-N |