1-{7-[(diethylamino)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}-2-(4-methylphenoxy)ethan-1-one
Chemical Structure Depiction of
1-{7-[(diethylamino)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}-2-(4-methylphenoxy)ethan-1-one
1-{7-[(diethylamino)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}-2-(4-methylphenoxy)ethan-1-one
Compound characteristics
| Compound ID: | T634-0400 |
| Compound Name: | 1-{7-[(diethylamino)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}-2-(4-methylphenoxy)ethan-1-one |
| Molecular Weight: | 382.5 |
| Molecular Formula: | C23 H30 N2 O3 |
| Smiles: | CCN(CC)Cc1ccc2c(CN(CCO2)C(COc2ccc(C)cc2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.5106 |
| logD: | 1.757 |
| logSw: | -3.359 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 35.235 |
| InChI Key: | ZIVJVFLEGJDQMS-UHFFFAOYSA-N |