4-[2-(3-bromo-4-methylphenyl)hydrazinylidene]-5-oxo-3-phenyl-4,5-dihydro-1H-pyrazole-1-carbothioamide
Chemical Structure Depiction of
4-[2-(3-bromo-4-methylphenyl)hydrazinylidene]-5-oxo-3-phenyl-4,5-dihydro-1H-pyrazole-1-carbothioamide
4-[2-(3-bromo-4-methylphenyl)hydrazinylidene]-5-oxo-3-phenyl-4,5-dihydro-1H-pyrazole-1-carbothioamide
Compound characteristics
| Compound ID: | 1697-1327 |
| Compound Name: | 4-[2-(3-bromo-4-methylphenyl)hydrazinylidene]-5-oxo-3-phenyl-4,5-dihydro-1H-pyrazole-1-carbothioamide |
| Molecular Weight: | 416.3 |
| Molecular Formula: | C17 H14 Br N5 O S |
| Smiles: | Cc1ccc(cc1[Br])N/N=C1\C(c2ccccc2)=NN(C1=O)C(N)=S |
| Stereo: | ACHIRAL |
| logP: | 3.792 |
| logD: | 3.792 |
| logSw: | -4.0489 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 62.898 |
| InChI Key: | IZIMNTLDZJVSBC-UHFFFAOYSA-N |