2-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-N-[(oxolan-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-N-[(oxolan-2-yl)methyl]acetamide
2-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-N-[(oxolan-2-yl)methyl]acetamide
Compound characteristics
Compound ID: | Y500-0987 |
Compound Name: | 2-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-N-[(oxolan-2-yl)methyl]acetamide |
Molecular Weight: | 370.17 |
Molecular Formula: | C12 H15 Br F3 N3 O2 |
Smiles: | Cc1c(c(C(F)(F)F)nn1CC(NCC1CCCO1)=O)[Br] |
Stereo: | RACEMIC MIXTURE |
logP: | 1.0983 |
logD: | 1.0983 |
logSw: | -1.481 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 47.84 |
InChI Key: | OXCCUTISGGTGJN-MRVPVSSYSA-N |