2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-5-methyl-4-[2-(2-methyl-6-nitrophenyl)hydrazinylidene]-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-5-methyl-4-[2-(2-methyl-6-nitrophenyl)hydrazinylidene]-2,4-dihydro-3H-pyrazol-3-one
2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-5-methyl-4-[2-(2-methyl-6-nitrophenyl)hydrazinylidene]-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 1951-2598 |
| Compound Name: | 2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-5-methyl-4-[2-(2-methyl-6-nitrophenyl)hydrazinylidene]-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 454.89 |
| Molecular Formula: | C20 H15 Cl N6 O3 S |
| Smiles: | CC1\C(C(N(c2nc(cs2)c2ccc(cc2)[Cl])N=1)=O)=N/Nc1c(C)cccc1[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.6695 |
| logD: | 5.6543 |
| logSw: | -6.0567 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.796 |
| InChI Key: | AFKDZNXMCWJKAG-UHFFFAOYSA-N |