3-[4-(cyclopropanecarbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-{3-[(propan-2-yl)oxy]propyl}propanamide
Chemical Structure Depiction of
3-[4-(cyclopropanecarbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-{3-[(propan-2-yl)oxy]propyl}propanamide
3-[4-(cyclopropanecarbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-{3-[(propan-2-yl)oxy]propyl}propanamide
Compound characteristics
| Compound ID: | S629-0833 |
| Compound Name: | 3-[4-(cyclopropanecarbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-{3-[(propan-2-yl)oxy]propyl}propanamide |
| Molecular Weight: | 388.51 |
| Molecular Formula: | C22 H32 N2 O4 |
| Smiles: | CC(C)OCCCNC(CCc1ccc2c(CN(CCO2)C(C2CC2)=O)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.193 |
| logD: | 2.193 |
| logSw: | -2.8699 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.868 |
| InChI Key: | YBFWLIRMRQKADN-UHFFFAOYSA-N |