[7-(dimethylamino)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl](1,3-dimethyl-1H-pyrazol-4-yl)methanone
Chemical Structure Depiction of
[7-(dimethylamino)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl](1,3-dimethyl-1H-pyrazol-4-yl)methanone
[7-(dimethylamino)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl](1,3-dimethyl-1H-pyrazol-4-yl)methanone
Compound characteristics
| Compound ID: | S555-2097 |
| Compound Name: | [7-(dimethylamino)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl](1,3-dimethyl-1H-pyrazol-4-yl)methanone |
| Molecular Weight: | 314.39 |
| Molecular Formula: | C17 H22 N4 O2 |
| Smiles: | Cc1c(cn(C)n1)C(N1CCOc2ccc(cc2C1)N(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5408 |
| logD: | 1.5344 |
| logSw: | -2.2046 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 42.798 |
| InChI Key: | VKVNBFDVAUFPPA-UHFFFAOYSA-N |