ethyl 1-[3-amino-4-(2H-1,3-benzodioxol-5-yl)-2-methyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl]piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-[3-amino-4-(2H-1,3-benzodioxol-5-yl)-2-methyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl]piperidine-4-carboxylate
ethyl 1-[3-amino-4-(2H-1,3-benzodioxol-5-yl)-2-methyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl]piperidine-4-carboxylate
Compound characteristics
| Compound ID: | V006-1121 |
| Compound Name: | ethyl 1-[3-amino-4-(2H-1,3-benzodioxol-5-yl)-2-methyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl]piperidine-4-carboxylate |
| Molecular Weight: | 424.46 |
| Molecular Formula: | C21 H24 N6 O4 |
| Salt: | not_available |
| Smiles: | CCOC(C1CCN(CC1)c1nc(c2ccc3c(c2)OCO3)c2c(n1)nn(C)c2N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9714 |
| logD: | 2.9709 |
| logSw: | -3.2987 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.112 |
| InChI Key: | JKTQYWKHAUNUOE-UHFFFAOYSA-N |