(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)(2-chloro-5-nitrophenyl)methanone
Chemical Structure Depiction of
(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)(2-chloro-5-nitrophenyl)methanone
(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)(2-chloro-5-nitrophenyl)methanone
Compound characteristics
| Compound ID: | 4487-0663 |
| Compound Name: | (4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)(2-chloro-5-nitrophenyl)methanone |
| Molecular Weight: | 358.58 |
| Molecular Formula: | C12 H9 Br Cl N3 O3 |
| Smiles: | Cc1c(c(C)n(C(c2cc(ccc2[Cl])[N+]([O-])=O)=O)n1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.8148 |
| logD: | 2.8148 |
| logSw: | -3.629 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.234 |
| InChI Key: | GGPUIFKDHLJARS-UHFFFAOYSA-N |