1-(azepan-1-yl)-2-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]ethan-1-one
Chemical Structure Depiction of
1-(azepan-1-yl)-2-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]ethan-1-one
1-(azepan-1-yl)-2-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | 1890-0645 |
| Compound Name: | 1-(azepan-1-yl)-2-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]ethan-1-one |
| Molecular Weight: | 368.19 |
| Molecular Formula: | C13 H17 Br F3 N3 O |
| Smiles: | Cc1c(c(C(F)(F)F)nn1CC(N1CCCCCC1)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.5107 |
| logD: | 2.5107 |
| logSw: | -2.0838 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 31.4373 |
| InChI Key: | DLZNUTCESSVRRL-UHFFFAOYSA-N |