2-(3-fluorophenyl)-1-[(3S)-3-methyl-7-[(morpholin-4-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]ethan-1-one
Chemical Structure Depiction of
2-(3-fluorophenyl)-1-[(3S)-3-methyl-7-[(morpholin-4-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]ethan-1-one
2-(3-fluorophenyl)-1-[(3S)-3-methyl-7-[(morpholin-4-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]ethan-1-one
Compound characteristics
| Compound ID: | S978-0223 |
| Compound Name: | 2-(3-fluorophenyl)-1-[(3S)-3-methyl-7-[(morpholin-4-yl)methyl]-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]ethan-1-one |
| Molecular Weight: | 398.48 |
| Molecular Formula: | C23 H27 F N2 O3 |
| Smiles: | C[C@H]1COc2ccc(CN3CCOCC3)cc2CN1C(Cc1cccc(c1)F)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.173 |
| logD: | 3.1111 |
| logSw: | -3.128 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 35.728 |
| InChI Key: | WEUPYYJSWIHLAF-KRWDZBQOSA-N |