1-[5-hydroxy-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-3-(2-hydroxyphenyl)propan-1-one
Chemical Structure Depiction of
1-[5-hydroxy-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-3-(2-hydroxyphenyl)propan-1-one
1-[5-hydroxy-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-3-(2-hydroxyphenyl)propan-1-one
Compound characteristics
Compound ID: | D015-0272 |
Compound Name: | 1-[5-hydroxy-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-3-(2-hydroxyphenyl)propan-1-one |
Molecular Weight: | 316.28 |
Molecular Formula: | C14 H15 F3 N2 O3 |
Smiles: | CC1CC(C(F)(F)F)(N(C(CCc2ccccc2O)=O)N=1)O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.0827 |
logD: | 2.0825 |
logSw: | -2.1225 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 58.984 |
InChI Key: | QAMLFHUAOAAVML-ZDUSSCGKSA-N |