1-(azepan-1-yl)-2-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]propan-1-one
Chemical Structure Depiction of
1-(azepan-1-yl)-2-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]propan-1-one
1-(azepan-1-yl)-2-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]propan-1-one
Compound characteristics
| Compound ID: | Y508-3901 |
| Compound Name: | 1-(azepan-1-yl)-2-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]propan-1-one |
| Molecular Weight: | 382.22 |
| Molecular Formula: | C14 H19 Br F3 N3 O |
| Smiles: | CC(C(N1CCCCCC1)=O)n1c(C)c(c(C(F)(F)F)n1)[Br] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0351 |
| logD: | 3.0351 |
| logSw: | -2.9425 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 32.053 |
| InChI Key: | RQWXZOMZKQJTQY-JTQLQIEISA-N |