2-{3-[(naphthalen-1-yl)methyl]-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl}-1,2,3,4-tetrahydroisoquinoline
Chemical Structure Depiction of
2-{3-[(naphthalen-1-yl)methyl]-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl}-1,2,3,4-tetrahydroisoquinoline
2-{3-[(naphthalen-1-yl)methyl]-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl}-1,2,3,4-tetrahydroisoquinoline
Compound characteristics
| Compound ID: | 8017-5538 |
| Compound Name: | 2-{3-[(naphthalen-1-yl)methyl]-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl}-1,2,3,4-tetrahydroisoquinoline |
| Molecular Weight: | 392.46 |
| Molecular Formula: | C24 H20 N6 |
| Smiles: | C1CN(Cc2ccccc12)c1c2c(ncn1)n(Cc1cccc3ccccc13)nn2 |
| Stereo: | ACHIRAL |
| logP: | 4.6472 |
| logD: | 4.6471 |
| logSw: | -5.1889 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 49.879 |
| InChI Key: | LVBJPEAGKJMKAU-UHFFFAOYSA-N |