5-{[(4-chlorophenyl)sulfanyl]methyl}-4-[(2-methoxyphenyl)methylidene]-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
5-{[(4-chlorophenyl)sulfanyl]methyl}-4-[(2-methoxyphenyl)methylidene]-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
5-{[(4-chlorophenyl)sulfanyl]methyl}-4-[(2-methoxyphenyl)methylidene]-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 3947-1894 |
| Compound Name: | 5-{[(4-chlorophenyl)sulfanyl]methyl}-4-[(2-methoxyphenyl)methylidene]-2-phenyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 434.94 |
| Molecular Formula: | C24 H19 Cl N2 O2 S |
| Smiles: | COc1ccccc1\C=C1/C(CSc2ccc(cc2)[Cl])=NN(C1=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.9793 |
| logD: | 5.9793 |
| logSw: | -6.0744 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.676 |
| InChI Key: | TWOWNYKHZHUMKF-UHFFFAOYSA-N |