4-(3-chlorophenyl)-1-(4,6-dimethylpyrimidin-2-yl)-7-[(4-fluorophenyl)methyl]-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
4-(3-chlorophenyl)-1-(4,6-dimethylpyrimidin-2-yl)-7-[(4-fluorophenyl)methyl]-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
4-(3-chlorophenyl)-1-(4,6-dimethylpyrimidin-2-yl)-7-[(4-fluorophenyl)methyl]-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | D292-0249 |
| Compound Name: | 4-(3-chlorophenyl)-1-(4,6-dimethylpyrimidin-2-yl)-7-[(4-fluorophenyl)methyl]-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 475.95 |
| Molecular Formula: | C26 H23 Cl F N5 O |
| Smiles: | Cc1cc(C)nc(n1)n1c2c(C(CC(N2Cc2ccc(cc2)F)=O)c2cccc(c2)[Cl])c(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0471 |
| logD: | 4.901 |
| logSw: | -5.1614 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 46.883 |
| InChI Key: | MZKQTSKWUFNDTD-JOCHJYFZSA-N |