1-[7-(dimethylamino)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]-2-(2-methyl-1H-imidazol-1-yl)ethan-1-one
Chemical Structure Depiction of
1-[7-(dimethylamino)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]-2-(2-methyl-1H-imidazol-1-yl)ethan-1-one
1-[7-(dimethylamino)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]-2-(2-methyl-1H-imidazol-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | S555-2089 |
| Compound Name: | 1-[7-(dimethylamino)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]-2-(2-methyl-1H-imidazol-1-yl)ethan-1-one |
| Molecular Weight: | 314.39 |
| Molecular Formula: | C17 H22 N4 O2 |
| Smiles: | Cc1nccn1CC(N1CCOc2ccc(cc2C1)N(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2486 |
| logD: | 0.2235 |
| logSw: | -2.0293 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 39.666 |
| InChI Key: | QDLKMURNQFGIRY-UHFFFAOYSA-N |