4-[4-(benzyloxy)-3-methoxyphenyl]-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-[4-(benzyloxy)-3-methoxyphenyl]-1-(4,6-dimethylpyrimidin-2-yl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
4-[4-(benzyloxy)-3-methoxyphenyl]-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: | D292-0024 |
Compound Name: | 4-[4-(benzyloxy)-3-methoxyphenyl]-1-(4,6-dimethylpyrimidin-2-yl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
Molecular Weight: | 469.54 |
Molecular Formula: | C27 H27 N5 O3 |
Smiles: | Cc1cc(C)nc(n1)n1c2c(C(CC(N2)=O)c2ccc(c(c2)OC)OCc2ccccc2)c(C)n1 |
Stereo: | RACEMIC MIXTURE |
logP: | 3.563 |
logD: | 3.4874 |
logSw: | -3.8107 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 71.147 |
InChI Key: | PLNHKZBOJBNQPM-NRFANRHFSA-N |