2-{2-[(4-chlorophenyl)methyl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}-1,2,3,4-tetrahydroisoquinoline
Chemical Structure Depiction of
2-{2-[(4-chlorophenyl)methyl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}-1,2,3,4-tetrahydroisoquinoline
2-{2-[(4-chlorophenyl)methyl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}-1,2,3,4-tetrahydroisoquinoline
Compound characteristics
| Compound ID: | D245-0602 |
| Compound Name: | 2-{2-[(4-chlorophenyl)methyl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}-1,2,3,4-tetrahydroisoquinoline |
| Molecular Weight: | 389.89 |
| Molecular Formula: | C22 H20 Cl N5 |
| Smiles: | Cc1cc(N2CCc3ccccc3C2)n2c(n1)nc(Cc1ccc(cc1)[Cl])n2 |
| Stereo: | ACHIRAL |
| logP: | 4.8998 |
| logD: | 4.825 |
| logSw: | -4.8703 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 33.77 |
| InChI Key: | FDLTUYZVJHDPGU-UHFFFAOYSA-N |