7-benzyl-1-(4,6-dimethylpyrimidin-2-yl)-4-(2-ethoxyphenyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
7-benzyl-1-(4,6-dimethylpyrimidin-2-yl)-4-(2-ethoxyphenyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
7-benzyl-1-(4,6-dimethylpyrimidin-2-yl)-4-(2-ethoxyphenyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | D292-0113 |
| Compound Name: | 7-benzyl-1-(4,6-dimethylpyrimidin-2-yl)-4-(2-ethoxyphenyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 467.57 |
| Molecular Formula: | C28 H29 N5 O2 |
| Smiles: | CCOc1ccccc1C1CC(N(Cc2ccccc2)c2c1c(C)nn2c1nc(C)cc(C)n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9575 |
| logD: | 4.8114 |
| logSw: | -4.6296 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 54.093 |
| InChI Key: | ZTMOFYNESGEVIR-QHCPKHFHSA-N |