2-{6-[(4-fluorophenyl)methyl]-2-methyl-5,7-dioxo-2,5,6,7-tetrahydro-4H-pyrazolo[4,3-d]pyrimidin-4-yl}-N-[2-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of
2-{6-[(4-fluorophenyl)methyl]-2-methyl-5,7-dioxo-2,5,6,7-tetrahydro-4H-pyrazolo[4,3-d]pyrimidin-4-yl}-N-[2-(trifluoromethyl)phenyl]acetamide
2-{6-[(4-fluorophenyl)methyl]-2-methyl-5,7-dioxo-2,5,6,7-tetrahydro-4H-pyrazolo[4,3-d]pyrimidin-4-yl}-N-[2-(trifluoromethyl)phenyl]acetamide
Compound characteristics
Compound ID: | L681-0244 |
Compound Name: | 2-{6-[(4-fluorophenyl)methyl]-2-methyl-5,7-dioxo-2,5,6,7-tetrahydro-4H-pyrazolo[4,3-d]pyrimidin-4-yl}-N-[2-(trifluoromethyl)phenyl]acetamide |
Molecular Weight: | 475.4 |
Molecular Formula: | C22 H17 F4 N5 O3 |
Smiles: | Cn1cc2c(C(N(Cc3ccc(cc3)F)C(N2CC(Nc2ccccc2C(F)(F)F)=O)=O)=O)n1 |
Stereo: | ACHIRAL |
logP: | 2.9239 |
logD: | 2.9239 |
logSw: | -3.5002 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 69.165 |
InChI Key: | FETKQVFYPXFDFU-UHFFFAOYSA-N |