{7-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}(furan-2-yl)methanone
Chemical Structure Depiction of
{7-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}(furan-2-yl)methanone
{7-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}(furan-2-yl)methanone
Compound characteristics
| Compound ID: | T634-0850 |
| Compound Name: | {7-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}(furan-2-yl)methanone |
| Molecular Weight: | 388.47 |
| Molecular Formula: | C24 H24 N2 O3 |
| Smiles: | C1CN(Cc2ccc3c(CN(CCO3)C(c3ccco3)=O)c2)Cc2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 3.7205 |
| logD: | 3.3417 |
| logSw: | -3.9796 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.804 |
| InChI Key: | MGCAQJDGGFTKIK-UHFFFAOYSA-N |