3-(4-acetyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-N-[2-(cyclohex-1-en-1-yl)ethyl]propanamide
Chemical Structure Depiction of
3-(4-acetyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-N-[2-(cyclohex-1-en-1-yl)ethyl]propanamide
3-(4-acetyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-N-[2-(cyclohex-1-en-1-yl)ethyl]propanamide
Compound characteristics
| Compound ID: | S629-0059 |
| Compound Name: | 3-(4-acetyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-N-[2-(cyclohex-1-en-1-yl)ethyl]propanamide |
| Molecular Weight: | 370.49 |
| Molecular Formula: | C22 H30 N2 O3 |
| Smiles: | CC(N1CCOc2ccc(CCC(NCCC3CCCCC=3)=O)cc2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6228 |
| logD: | 2.6228 |
| logSw: | -2.9619 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.804 |
| InChI Key: | BQQOABOPABBDSA-UHFFFAOYSA-N |