2-[1-(3-chloro-4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,2,3,4-tetrahydroisoquinoline
Chemical Structure Depiction of
2-[1-(3-chloro-4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,2,3,4-tetrahydroisoquinoline
2-[1-(3-chloro-4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,2,3,4-tetrahydroisoquinoline
Compound characteristics
| Compound ID: | K405-3266 |
| Compound Name: | 2-[1-(3-chloro-4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,2,3,4-tetrahydroisoquinoline |
| Molecular Weight: | 375.86 |
| Molecular Formula: | C21 H18 Cl N5 |
| Smiles: | Cc1ccc(cc1[Cl])n1c2c(cn1)c(ncn2)N1CCc2ccccc2C1 |
| Stereo: | ACHIRAL |
| logP: | 5.664 |
| logD: | 5.6625 |
| logSw: | -6.0902 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 37.523 |
| InChI Key: | IEMLZTOFEBJMTG-UHFFFAOYSA-N |