1-[3-butyl-5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(3,4-dimethylphenoxy)ethan-1-one
Chemical Structure Depiction of
1-[3-butyl-5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(3,4-dimethylphenoxy)ethan-1-one
1-[3-butyl-5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(3,4-dimethylphenoxy)ethan-1-one
Compound characteristics
Compound ID: | 4607-1269 |
Compound Name: | 1-[3-butyl-5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(3,4-dimethylphenoxy)ethan-1-one |
Molecular Weight: | 372.39 |
Molecular Formula: | C18 H23 F3 N2 O3 |
Smiles: | CCCCC1CC(C(F)(F)F)(N(C(COc2ccc(C)c(C)c2)=O)N=1)O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.1346 |
logD: | 4.1346 |
logSw: | -4.094 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 50.665 |
InChI Key: | GCJPSJWHNFDLAD-KRWDZBQOSA-N |