3-[4-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-1-(morpholin-4-yl)propan-1-one
Chemical Structure Depiction of
3-[4-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-1-(morpholin-4-yl)propan-1-one
3-[4-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-1-(morpholin-4-yl)propan-1-one
Compound characteristics
| Compound ID: | S629-2581 |
| Compound Name: | 3-[4-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-1-(morpholin-4-yl)propan-1-one |
| Molecular Weight: | 452.51 |
| Molecular Formula: | C25 H28 N2 O6 |
| Smiles: | C(Cc1ccc2c(CN(CCO2)C(C2COc3ccccc3O2)=O)c1)C(N1CCOCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3151 |
| logD: | 2.3151 |
| logSw: | -2.7623 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.297 |
| InChI Key: | JXLKFFLKTFFSHJ-QHCPKHFHSA-N |