3-(4-acetyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-N-[(oxolan-2-yl)methyl]propanamide
Chemical Structure Depiction of
3-(4-acetyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-N-[(oxolan-2-yl)methyl]propanamide
3-(4-acetyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-N-[(oxolan-2-yl)methyl]propanamide
Compound characteristics
| Compound ID: | S629-0186 |
| Compound Name: | 3-(4-acetyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-N-[(oxolan-2-yl)methyl]propanamide |
| Molecular Weight: | 346.43 |
| Molecular Formula: | C19 H26 N2 O4 |
| Smiles: | CC(N1CCOc2ccc(CCC(NCC3CCCO3)=O)cc2C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.9331 |
| logD: | 0.9331 |
| logSw: | -2.1343 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.425 |
| InChI Key: | QDUBMOVGNVJFOO-QGZVFWFLSA-N |