N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-5-methyl-3-(propan-2-yl)-5,6-dihydro-8H-[1,2,4]triazolo[3,4-c][1,4]oxazine-5-carboxamide
Chemical Structure Depiction of
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-5-methyl-3-(propan-2-yl)-5,6-dihydro-8H-[1,2,4]triazolo[3,4-c][1,4]oxazine-5-carboxamide
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-5-methyl-3-(propan-2-yl)-5,6-dihydro-8H-[1,2,4]triazolo[3,4-c][1,4]oxazine-5-carboxamide
Compound characteristics
| Compound ID: | SA31-1562 |
| Compound Name: | N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-5-methyl-3-(propan-2-yl)-5,6-dihydro-8H-[1,2,4]triazolo[3,4-c][1,4]oxazine-5-carboxamide |
| Molecular Weight: | 397.52 |
| Molecular Formula: | C22 H31 N5 O2 |
| Smiles: | CC(C)c1nnc2COCC(C)(C(NCCCN3CCc4ccccc4C3)=O)n12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7663 |
| logD: | 0.5622 |
| logSw: | -2.2223 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.84 |
| InChI Key: | OKHBIRJTJRZPJL-QFIPXVFZSA-N |