5-methyl-4-[2-(2-nitrophenyl)hydrazinylidene]-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
5-methyl-4-[2-(2-nitrophenyl)hydrazinylidene]-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2,4-dihydro-3H-pyrazol-3-one
5-methyl-4-[2-(2-nitrophenyl)hydrazinylidene]-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 1652-1565 |
| Compound Name: | 5-methyl-4-[2-(2-nitrophenyl)hydrazinylidene]-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 451.42 |
| Molecular Formula: | C19 H13 N7 O5 S |
| Smiles: | CC1\C(C(N(c2nc(cs2)c2cccc(c2)[N+]([O-])=O)N=1)=O)=N/Nc1ccccc1[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.2617 |
| logD: | 5.2528 |
| logSw: | -5.201 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 120.875 |
| InChI Key: | VLMMUZUQAWTHBH-UHFFFAOYSA-N |