1-(4-bromo-1H-pyrazol-1-yl)-2-(5-methyl-3-nitro-1H-pyrazol-1-yl)ethan-1-one
Chemical Structure Depiction of
1-(4-bromo-1H-pyrazol-1-yl)-2-(5-methyl-3-nitro-1H-pyrazol-1-yl)ethan-1-one
1-(4-bromo-1H-pyrazol-1-yl)-2-(5-methyl-3-nitro-1H-pyrazol-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | 8017-4530 |
| Compound Name: | 1-(4-bromo-1H-pyrazol-1-yl)-2-(5-methyl-3-nitro-1H-pyrazol-1-yl)ethan-1-one |
| Molecular Weight: | 314.09 |
| Molecular Formula: | C9 H8 Br N5 O3 |
| Smiles: | Cc1cc(nn1CC(n1cc(cn1)[Br])=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.3216 |
| logD: | 0.3216 |
| logSw: | -1.0738 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 74.31 |
| InChI Key: | LYQJPCRMUTZDCD-UHFFFAOYSA-N |