(azepan-1-yl)[4-bromo-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]methanone
Chemical Structure Depiction of
(azepan-1-yl)[4-bromo-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]methanone
(azepan-1-yl)[4-bromo-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]methanone
Compound characteristics
| Compound ID: | Y500-2402 |
| Compound Name: | (azepan-1-yl)[4-bromo-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]methanone |
| Molecular Weight: | 354.17 |
| Molecular Formula: | C12 H15 Br F3 N3 O |
| Smiles: | Cn1c(C(N2CCCCCC2)=O)c(c(C(F)(F)F)n1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.6311 |
| logD: | 2.6311 |
| logSw: | -2.4815 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 31.2801 |
| InChI Key: | UTGPSGKFCPQOFT-UHFFFAOYSA-N |