1-{7-[3-(morpholin-4-yl)-3-oxopropyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}-2-phenoxypropan-1-one
Chemical Structure Depiction of
1-{7-[3-(morpholin-4-yl)-3-oxopropyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}-2-phenoxypropan-1-one
1-{7-[3-(morpholin-4-yl)-3-oxopropyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}-2-phenoxypropan-1-one
Compound characteristics
| Compound ID: | S629-2584 |
| Compound Name: | 1-{7-[3-(morpholin-4-yl)-3-oxopropyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl}-2-phenoxypropan-1-one |
| Molecular Weight: | 438.52 |
| Molecular Formula: | C25 H30 N2 O5 |
| Smiles: | CC(C(N1CCOc2ccc(CCC(N3CCOCC3)=O)cc2C1)=O)Oc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5774 |
| logD: | 2.5774 |
| logSw: | -2.8165 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.649 |
| InChI Key: | OLTYRXYBWAUVCZ-IBGZPJMESA-N |