4-[2-(2-benzoyl-4-chlorophenyl)hydrazinylidene]-5-methyl-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-[2-(2-benzoyl-4-chlorophenyl)hydrazinylidene]-5-methyl-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2,4-dihydro-3H-pyrazol-3-one
4-[2-(2-benzoyl-4-chlorophenyl)hydrazinylidene]-5-methyl-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 1697-1415 |
| Compound Name: | 4-[2-(2-benzoyl-4-chlorophenyl)hydrazinylidene]-5-methyl-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 544.98 |
| Molecular Formula: | C26 H17 Cl N6 O4 S |
| Smiles: | CC1\C(C(N(c2nc(cs2)c2cccc(c2)[N+]([O-])=O)N=1)=O)=N/Nc1ccc(cc1C(c1ccccc1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 7.0441 |
| logD: | 7.0409 |
| logSw: | -6.2918 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 101.261 |
| InChI Key: | DMCGFEMSHKFEBM-UHFFFAOYSA-N |