3-methoxy-1-{7-[(morpholin-4-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}propan-1-one
Chemical Structure Depiction of
3-methoxy-1-{7-[(morpholin-4-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}propan-1-one
3-methoxy-1-{7-[(morpholin-4-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}propan-1-one
Compound characteristics
Compound ID: | T634-0087 |
Compound Name: | 3-methoxy-1-{7-[(morpholin-4-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}propan-1-one |
Molecular Weight: | 334.41 |
Molecular Formula: | C18 H26 N2 O4 |
Smiles: | COCCC(N1CCOc2ccc(CN3CCOCC3)cc2C1)=O |
Stereo: | ACHIRAL |
logP: | 0.7851 |
logD: | 0.7232 |
logSw: | -1.7191 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 44.559 |
InChI Key: | XVKGVSRGBDVJNF-UHFFFAOYSA-N |