[7-(dimethylamino)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl](3-methyl-1H-pyrazol-5-yl)methanone
Chemical Structure Depiction of
[7-(dimethylamino)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl](3-methyl-1H-pyrazol-5-yl)methanone
[7-(dimethylamino)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl](3-methyl-1H-pyrazol-5-yl)methanone
Compound characteristics
| Compound ID: | S555-1879 |
| Compound Name: | [7-(dimethylamino)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl](3-methyl-1H-pyrazol-5-yl)methanone |
| Molecular Weight: | 300.36 |
| Molecular Formula: | C16 H20 N4 O2 |
| Smiles: | Cc1cc(C(N2CCOc3ccc(cc3C2)N(C)C)=O)[nH]n1 |
| Stereo: | ACHIRAL |
| logP: | 2.1243 |
| logD: | 2.1178 |
| logSw: | -2.9548 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.203 |
| InChI Key: | WVQBCMWACWKVHJ-UHFFFAOYSA-N |