N-[(2,5-dimethylphenyl)methyl]-1-[2-(4-methylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-yl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-[(2,5-dimethylphenyl)methyl]-1-[2-(4-methylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-yl]piperidine-4-carboxamide
N-[(2,5-dimethylphenyl)methyl]-1-[2-(4-methylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-yl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | L094-3138 |
| Compound Name: | N-[(2,5-dimethylphenyl)methyl]-1-[2-(4-methylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-yl]piperidine-4-carboxamide |
| Molecular Weight: | 454.57 |
| Molecular Formula: | C27 H30 N6 O |
| Smiles: | Cc1ccc(cc1)n1cc2c(ncnc2n1)N1CCC(CC1)C(NCc1cc(C)ccc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1984 |
| logD: | 5.191 |
| logSw: | -4.9301 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.022 |
| InChI Key: | BJHVACXMQXCJET-UHFFFAOYSA-N |