1-[3-(4-ethylphenyl)-5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-phenoxyethan-1-one
Chemical Structure Depiction of
1-[3-(4-ethylphenyl)-5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-phenoxyethan-1-one
1-[3-(4-ethylphenyl)-5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-phenoxyethan-1-one
Compound characteristics
Compound ID: | 5634-0202 |
Compound Name: | 1-[3-(4-ethylphenyl)-5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-phenoxyethan-1-one |
Molecular Weight: | 392.38 |
Molecular Formula: | C20 H19 F3 N2 O3 |
Smiles: | CCc1ccc(cc1)C1CC(C(F)(F)F)(N(C(COc2ccccc2)=O)N=1)O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.0272 |
logD: | 4.0272 |
logSw: | -4.0417 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 50.49 |
InChI Key: | KILYXEZTWYPKIW-IBGZPJMESA-N |