4-[(1,5-dimethyl-1H-pyrazol-3-yl)methylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-[(1,5-dimethyl-1H-pyrazol-3-yl)methylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
4-[(1,5-dimethyl-1H-pyrazol-3-yl)methylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | Y502-2010 |
| Compound Name: | 4-[(1,5-dimethyl-1H-pyrazol-3-yl)methylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 280.33 |
| Molecular Formula: | C16 H16 N4 O |
| Smiles: | CC1/C(=C/c2cc(C)n(C)n2)C(N(c2ccccc2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8586 |
| logD: | 1.8586 |
| logSw: | -2.2558 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 40.569 |
| InChI Key: | LQCVWCPUWGHKFZ-UHFFFAOYSA-N |