3-(4-acetyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-1-(2-ethylpiperidin-1-yl)propan-1-one
Chemical Structure Depiction of
3-(4-acetyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-1-(2-ethylpiperidin-1-yl)propan-1-one
3-(4-acetyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-1-(2-ethylpiperidin-1-yl)propan-1-one
Compound characteristics
| Compound ID: | S629-0786 |
| Compound Name: | 3-(4-acetyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-1-(2-ethylpiperidin-1-yl)propan-1-one |
| Molecular Weight: | 358.48 |
| Molecular Formula: | C21 H30 N2 O3 |
| Smiles: | CCC1CCCCN1C(CCc1ccc2c(CN(CCO2)C(C)=O)c1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8846 |
| logD: | 2.8846 |
| logSw: | -3.0067 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.338 |
| InChI Key: | ORILHLOUQYQFNR-IBGZPJMESA-N |