2-[2-(4-tert-butylphenyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-1,2,3,4-tetrahydroisoquinoline
Chemical Structure Depiction of
2-[2-(4-tert-butylphenyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-1,2,3,4-tetrahydroisoquinoline
2-[2-(4-tert-butylphenyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-1,2,3,4-tetrahydroisoquinoline
Compound characteristics
| Compound ID: | D245-0213 |
| Compound Name: | 2-[2-(4-tert-butylphenyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-1,2,3,4-tetrahydroisoquinoline |
| Molecular Weight: | 397.52 |
| Molecular Formula: | C25 H27 N5 |
| Smiles: | Cc1cc(N2CCc3ccccc3C2)n2c(n1)nc(c1ccc(cc1)C(C)(C)C)n2 |
| Stereo: | ACHIRAL |
| logP: | 6.3541 |
| logD: | 6.1201 |
| logSw: | -5.8063 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 32.779 |
| InChI Key: | OTEXSUWEPTUYKU-UHFFFAOYSA-N |