3-(4-acetyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-1-[2-(pyridin-3-yl)piperidin-1-yl]propan-1-one
Chemical Structure Depiction of
3-(4-acetyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-1-[2-(pyridin-3-yl)piperidin-1-yl]propan-1-one
3-(4-acetyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-1-[2-(pyridin-3-yl)piperidin-1-yl]propan-1-one
Compound characteristics
| Compound ID: | S629-0199 |
| Compound Name: | 3-(4-acetyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-1-[2-(pyridin-3-yl)piperidin-1-yl]propan-1-one |
| Molecular Weight: | 407.51 |
| Molecular Formula: | C24 H29 N3 O3 |
| Smiles: | CC(N1CCOc2ccc(CCC(N3CCCCC3c3cccnc3)=O)cc2C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3511 |
| logD: | 2.351 |
| logSw: | -2.2396 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.632 |
| InChI Key: | WXTPEXNLLAOHMA-QFIPXVFZSA-N |