3-(4-nitrophenyl)-5-oxo-4-[2-(2,4,6-tribromophenyl)hydrazinylidene]-4,5-dihydro-1H-pyrazole-1-carbothioamide
Chemical Structure Depiction of
3-(4-nitrophenyl)-5-oxo-4-[2-(2,4,6-tribromophenyl)hydrazinylidene]-4,5-dihydro-1H-pyrazole-1-carbothioamide
3-(4-nitrophenyl)-5-oxo-4-[2-(2,4,6-tribromophenyl)hydrazinylidene]-4,5-dihydro-1H-pyrazole-1-carbothioamide
Compound characteristics
| Compound ID: | 1652-1851 |
| Compound Name: | 3-(4-nitrophenyl)-5-oxo-4-[2-(2,4,6-tribromophenyl)hydrazinylidene]-4,5-dihydro-1H-pyrazole-1-carbothioamide |
| Molecular Weight: | 605.06 |
| Molecular Formula: | C16 H9 Br3 N6 O3 S |
| Smiles: | c1cc(ccc1C1\C(C(N(C(N)=S)N=1)=O)=N/Nc1c(cc(cc1[Br])[Br])[Br])[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.3692 |
| logD: | 4.367 |
| logSw: | -4.6061 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 94.884 |
| InChI Key: | DVMDXYPHLKNECL-UHFFFAOYSA-N |