N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-3-phenyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-3-phenyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-3-phenyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
Compound characteristics
| Compound ID: | SC25-0674 |
| Compound Name: | N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-3-phenyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide |
| Molecular Weight: | 401.51 |
| Molecular Formula: | C24 H27 N5 O |
| Smiles: | C1CC(C(NCCN2CCc3ccccc3C2)=O)c2nnc(c3ccccc3)n2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9047 |
| logD: | 2.3634 |
| logSw: | -3.2247 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.847 |
| InChI Key: | VUSSXUAMZYRKSE-OAQYLSRUSA-N |