5-methyl-2-phenyl-4-[(1-phenyl-3-{4-[(prop-2-en-1-yl)oxy]phenyl}-1H-pyrazol-4-yl)methylidene]-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
5-methyl-2-phenyl-4-[(1-phenyl-3-{4-[(prop-2-en-1-yl)oxy]phenyl}-1H-pyrazol-4-yl)methylidene]-2,4-dihydro-3H-pyrazol-3-one
5-methyl-2-phenyl-4-[(1-phenyl-3-{4-[(prop-2-en-1-yl)oxy]phenyl}-1H-pyrazol-4-yl)methylidene]-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | Y070-1160 |
| Compound Name: | 5-methyl-2-phenyl-4-[(1-phenyl-3-{4-[(prop-2-en-1-yl)oxy]phenyl}-1H-pyrazol-4-yl)methylidene]-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 460.54 |
| Molecular Formula: | C29 H24 N4 O2 |
| Smiles: | CC1/C(=C/c2cn(c3ccccc3)nc2c2ccc(cc2)OCC=C)C(N(c2ccccc2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4174 |
| logD: | 5.4174 |
| logSw: | -5.4325 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.637 |
| InChI Key: | XNJKDGVNGNJWIB-UHFFFAOYSA-N |