1-[7-(dimethylamino)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]-2-(4-fluorophenoxy)ethan-1-one
Chemical Structure Depiction of
1-[7-(dimethylamino)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]-2-(4-fluorophenoxy)ethan-1-one
1-[7-(dimethylamino)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]-2-(4-fluorophenoxy)ethan-1-one
Compound characteristics
| Compound ID: | S555-1828 |
| Compound Name: | 1-[7-(dimethylamino)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]-2-(4-fluorophenoxy)ethan-1-one |
| Molecular Weight: | 344.38 |
| Molecular Formula: | C19 H21 F N2 O3 |
| Smiles: | CN(C)c1ccc2c(CN(CCO2)C(COc2ccc(cc2)F)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.9042 |
| logD: | 2.8978 |
| logSw: | -3.2034 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 34.607 |
| InChI Key: | DYYVUZXLOAYMMH-UHFFFAOYSA-N |