2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-5-methyl-4-[2-(4-methyl-3-nitrophenyl)hydrazinylidene]-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-5-methyl-4-[2-(4-methyl-3-nitrophenyl)hydrazinylidene]-2,4-dihydro-3H-pyrazol-3-one
2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-5-methyl-4-[2-(4-methyl-3-nitrophenyl)hydrazinylidene]-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 1697-1453 |
| Compound Name: | 2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-5-methyl-4-[2-(4-methyl-3-nitrophenyl)hydrazinylidene]-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(cc2)[Br])N=1)=O)=N/Nc1ccc(C)c(c1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 6.5047 |
| logD: | 6.504 |
| logSw: | -5.6173 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.191 |
| InChI Key: | ZOYOWQJDTPIWQO-UHFFFAOYSA-N |