3-{4-[(4-fluorophenoxy)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-1-(morpholin-4-yl)propan-1-one
Chemical Structure Depiction of
3-{4-[(4-fluorophenoxy)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-1-(morpholin-4-yl)propan-1-one
3-{4-[(4-fluorophenoxy)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-1-(morpholin-4-yl)propan-1-one
Compound characteristics
| Compound ID: | S629-2627 |
| Compound Name: | 3-{4-[(4-fluorophenoxy)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-1-(morpholin-4-yl)propan-1-one |
| Molecular Weight: | 442.49 |
| Molecular Formula: | C24 H27 F N2 O5 |
| Smiles: | C(Cc1ccc2c(CN(CCO2)C(COc2ccc(cc2)F)=O)c1)C(N1CCOCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0658 |
| logD: | 2.0658 |
| logSw: | -2.6093 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.832 |
| InChI Key: | IUSGIGYDKVMASY-UHFFFAOYSA-N |