5-methyl-4-[(4-oxo-4H-1-benzopyran-3-yl)methylidene]-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
5-methyl-4-[(4-oxo-4H-1-benzopyran-3-yl)methylidene]-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
5-methyl-4-[(4-oxo-4H-1-benzopyran-3-yl)methylidene]-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | C679-1938 |
| Compound Name: | 5-methyl-4-[(4-oxo-4H-1-benzopyran-3-yl)methylidene]-2-phenyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 330.34 |
| Molecular Formula: | C20 H14 N2 O3 |
| Smiles: | CC1/C(=C\C2=COc3ccccc3C2=O)C(N(c2ccccc2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0498 |
| logD: | 3.0498 |
| logSw: | -3.7253 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.48 |
| InChI Key: | NFAZUNRFWZCXTK-UHFFFAOYSA-N |