4-[2-(4-iodophenyl)hydrazinylidene]-5-oxo-3-phenyl-4,5-dihydro-1H-pyrazole-1-carbothioamide
Chemical Structure Depiction of
4-[2-(4-iodophenyl)hydrazinylidene]-5-oxo-3-phenyl-4,5-dihydro-1H-pyrazole-1-carbothioamide
4-[2-(4-iodophenyl)hydrazinylidene]-5-oxo-3-phenyl-4,5-dihydro-1H-pyrazole-1-carbothioamide
Compound characteristics
| Compound ID: | 1697-1329 |
| Compound Name: | 4-[2-(4-iodophenyl)hydrazinylidene]-5-oxo-3-phenyl-4,5-dihydro-1H-pyrazole-1-carbothioamide |
| Molecular Weight: | 449.27 |
| Molecular Formula: | C16 H12 I N5 O S |
| Smiles: | c1ccc(cc1)C1\C(C(N(C(N)=S)N=1)=O)=N/Nc1ccc(cc1)I |
| Stereo: | ACHIRAL |
| logP: | 3.7997 |
| logD: | 3.7997 |
| logSw: | -4.2168 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 62.898 |
| InChI Key: | NMOBMVMDCLWEEF-UHFFFAOYSA-N |