{7-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}(oxolan-2-yl)methanone
Chemical Structure Depiction of
{7-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}(oxolan-2-yl)methanone
{7-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}(oxolan-2-yl)methanone
Compound characteristics
Compound ID: | T634-0851 |
Compound Name: | {7-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}(oxolan-2-yl)methanone |
Molecular Weight: | 392.5 |
Molecular Formula: | C24 H28 N2 O3 |
Smiles: | C1CC(C(N2CCOc3ccc(CN4CCc5ccccc5C4)cc3C2)=O)OC1 |
Stereo: | RACEMIC MIXTURE |
logP: | 3.0791 |
logD: | 2.7004 |
logSw: | -3.1175 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 36.637 |
InChI Key: | VZORXUZMNDYTMZ-QHCPKHFHSA-N |