1-oxo-2-(propan-2-yl)-N-[([1,2,4]triazolo[4,3-a]pyridin-3-yl)methyl]-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
1-oxo-2-(propan-2-yl)-N-[([1,2,4]triazolo[4,3-a]pyridin-3-yl)methyl]-1,2-dihydroisoquinoline-4-carboxamide
1-oxo-2-(propan-2-yl)-N-[([1,2,4]triazolo[4,3-a]pyridin-3-yl)methyl]-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y041-7644 |
| Compound Name: | 1-oxo-2-(propan-2-yl)-N-[([1,2,4]triazolo[4,3-a]pyridin-3-yl)methyl]-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 361.4 |
| Molecular Formula: | C20 H19 N5 O2 |
| Smiles: | CC(C)N1C=C(C(NCc2nnc3ccccn23)=O)c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 0.7802 |
| logD: | 0.7792 |
| logSw: | -2.0761 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.358 |
| InChI Key: | YZAOPJSHFMRXPE-UHFFFAOYSA-N |