3-(4-nitrophenyl)-4-[2-(2-nitrophenyl)hydrazinylidene]-5-oxo-4,5-dihydro-1H-pyrazole-1-carbothioamide
Chemical Structure Depiction of
3-(4-nitrophenyl)-4-[2-(2-nitrophenyl)hydrazinylidene]-5-oxo-4,5-dihydro-1H-pyrazole-1-carbothioamide
3-(4-nitrophenyl)-4-[2-(2-nitrophenyl)hydrazinylidene]-5-oxo-4,5-dihydro-1H-pyrazole-1-carbothioamide
Compound characteristics
| Compound ID: | 1652-1853 |
| Compound Name: | 3-(4-nitrophenyl)-4-[2-(2-nitrophenyl)hydrazinylidene]-5-oxo-4,5-dihydro-1H-pyrazole-1-carbothioamide |
| Molecular Weight: | 413.37 |
| Molecular Formula: | C16 H11 N7 O5 S |
| Smiles: | c1ccc(c(c1)N/N=C1\C(c2ccc(cc2)[N+]([O-])=O)=NN(C1=O)C(N)=S)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.9071 |
| logD: | 2.9044 |
| logSw: | -3.666 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 128.662 |
| InChI Key: | NSFWCAATOXHLEP-UHFFFAOYSA-N |