1-(4,6-dimethylpyrimidin-2-yl)-4-{4-[(2-fluorophenyl)methoxy]-3-methoxyphenyl}-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
1-(4,6-dimethylpyrimidin-2-yl)-4-{4-[(2-fluorophenyl)methoxy]-3-methoxyphenyl}-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
1-(4,6-dimethylpyrimidin-2-yl)-4-{4-[(2-fluorophenyl)methoxy]-3-methoxyphenyl}-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | D292-0028 |
| Compound Name: | 1-(4,6-dimethylpyrimidin-2-yl)-4-{4-[(2-fluorophenyl)methoxy]-3-methoxyphenyl}-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 487.53 |
| Molecular Formula: | C27 H26 F N5 O3 |
| Smiles: | Cc1cc(C)nc(n1)n1c2c(C(CC(N2)=O)c2ccc(c(c2)OC)OCc2ccccc2F)c(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6381 |
| logD: | 3.5624 |
| logSw: | -3.8892 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.147 |
| InChI Key: | QRHDIFBHRUABIX-HXUWFJFHSA-N |