N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-2-methyl-4-(pyrrolidin-1-yl)-2H-pyrazolo[3,4-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-2-methyl-4-(pyrrolidin-1-yl)-2H-pyrazolo[3,4-d]pyrimidine-6-carboxamide
N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-2-methyl-4-(pyrrolidin-1-yl)-2H-pyrazolo[3,4-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | T491-0203 |
| Compound Name: | N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-2-methyl-4-(pyrrolidin-1-yl)-2H-pyrazolo[3,4-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 405.5 |
| Molecular Formula: | C22 H27 N7 O |
| Smiles: | Cn1cc2c(nc(C(NCCN3CCc4ccccc4C3)=O)nc2n1)N1CCCC1 |
| Stereo: | ACHIRAL |
| logP: | 2.4296 |
| logD: | 2.0462 |
| logSw: | -2.6791 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.087 |
| InChI Key: | SUUBRLNGUGXBME-UHFFFAOYSA-N |