1-(4,6-dimethylpyrimidin-2-yl)-4-(4-ethoxy-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-ethoxy-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-ethoxy-3-methoxyphenyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | D292-0030 |
| Compound Name: | 1-(4,6-dimethylpyrimidin-2-yl)-4-(4-ethoxy-3-methoxyphenyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 407.47 |
| Molecular Formula: | C22 H25 N5 O3 |
| Smiles: | CCOc1ccc(cc1OC)C1CC(Nc2c1c(C)nn2c1nc(C)cc(C)n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3677 |
| logD: | 2.292 |
| logSw: | -2.9872 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.043 |
| InChI Key: | ATOUOHDQSMKXSB-INIZCTEOSA-N |