2-[1-(3-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,2,3,4-tetrahydroisoquinoline
Chemical Structure Depiction of
2-[1-(3-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,2,3,4-tetrahydroisoquinoline
2-[1-(3-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,2,3,4-tetrahydroisoquinoline
Compound characteristics
| Compound ID: | K405-3776 |
| Compound Name: | 2-[1-(3-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,2,3,4-tetrahydroisoquinoline |
| Molecular Weight: | 361.83 |
| Molecular Formula: | C20 H16 Cl N5 |
| Smiles: | C1CN(Cc2ccccc12)c1c2cnn(c3cccc(c3)[Cl])c2ncn1 |
| Stereo: | ACHIRAL |
| logP: | 5.0487 |
| logD: | 5.0472 |
| logSw: | -5.2017 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 37.523 |
| InChI Key: | CSRLWNUIHIVTBG-UHFFFAOYSA-N |