(2,5-difluorophenyl){7-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}methanone
Chemical Structure Depiction of
(2,5-difluorophenyl){7-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}methanone
(2,5-difluorophenyl){7-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}methanone
Compound characteristics
Compound ID: | T634-0814 |
Compound Name: | (2,5-difluorophenyl){7-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}methanone |
Molecular Weight: | 434.49 |
Molecular Formula: | C26 H24 F2 N2 O2 |
Smiles: | C1CN(Cc2ccc3c(CN(CCO3)C(c3cc(ccc3F)F)=O)c2)Cc2ccccc12 |
Stereo: | ACHIRAL |
logP: | 4.7783 |
logD: | 4.3996 |
logSw: | -4.7298 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 28.2254 |
InChI Key: | JIUYUYMYJPLAIU-UHFFFAOYSA-N |