1-(4,6-dimethylpyrimidin-2-yl)-4-{3-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}-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-{3-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
1-(4,6-dimethylpyrimidin-2-yl)-4-{3-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | D292-0033 |
| Compound Name: | 1-(4,6-dimethylpyrimidin-2-yl)-4-{3-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 419.48 |
| Molecular Formula: | C23 H25 N5 O3 |
| Smiles: | Cc1cc(C)nc(n1)n1c2c(C(CC(N2)=O)c2ccc(c(c2)OC)OCC=C)c(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8061 |
| logD: | 2.7305 |
| logSw: | -3.2286 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.337 |
| InChI Key: | WUKCCEPDBKJKSR-KRWDZBQOSA-N |