4-[2-(2-bromo-4-nitrophenyl)hydrazinylidene]-5-methyl-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-[2-(2-bromo-4-nitrophenyl)hydrazinylidene]-5-methyl-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-2,4-dihydro-3H-pyrazol-3-one
4-[2-(2-bromo-4-nitrophenyl)hydrazinylidene]-5-methyl-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 1697-1499 |
| Compound Name: | 4-[2-(2-bromo-4-nitrophenyl)hydrazinylidene]-5-methyl-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 499.34 |
| Molecular Formula: | C20 H15 Br N6 O3 S |
| Smiles: | CC1\C(C(N(c2nc(cs2)c2ccc(C)cc2)N=1)=O)=N/Nc1ccc(cc1[Br])[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 6.5934 |
| logD: | 6.5833 |
| logSw: | -5.5953 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.794 |
| InChI Key: | AVKRJLBLAGASDU-UHFFFAOYSA-N |