2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-1-(pyrrolidin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-1-(pyrrolidin-1-yl)ethan-1-one
2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-1-(pyrrolidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | 8016-7655 |
| Compound Name: | 2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-1-(pyrrolidin-1-yl)ethan-1-one |
| Molecular Weight: | 317.14 |
| Molecular Formula: | C10 H13 Br N4 O3 |
| Smiles: | Cc1c(c(nn1CC(N1CCCC1)=O)[N+]([O-])=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 0.9381 |
| logD: | 0.9381 |
| logSw: | -0.9842 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.016 |
| InChI Key: | OMMKGJBVDWSBME-UHFFFAOYSA-N |