4-(2-chloro-6-fluorophenyl)-1-(4,6-dimethylpyrimidin-2-yl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
4-(2-chloro-6-fluorophenyl)-1-(4,6-dimethylpyrimidin-2-yl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
4-(2-chloro-6-fluorophenyl)-1-(4,6-dimethylpyrimidin-2-yl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | D292-0057 |
| Compound Name: | 4-(2-chloro-6-fluorophenyl)-1-(4,6-dimethylpyrimidin-2-yl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 385.83 |
| Molecular Formula: | C19 H17 Cl F N5 O |
| Smiles: | Cc1cc(C)nc(n1)n1c2c(C(CC(N2)=O)c2c(cccc2[Cl])F)c(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7369 |
| logD: | 2.6613 |
| logSw: | -3.4723 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.202 |
| InChI Key: | UKEGJTGNVWFMPT-LBPRGKRZSA-N |