1-[(3S)-7-(4-fluorophenyl)-3-methyl-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]-2-(pyridin-3-yl)ethan-1-one
Chemical Structure Depiction of
1-[(3S)-7-(4-fluorophenyl)-3-methyl-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]-2-(pyridin-3-yl)ethan-1-one
1-[(3S)-7-(4-fluorophenyl)-3-methyl-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]-2-(pyridin-3-yl)ethan-1-one
Compound characteristics
| Compound ID: | SC09-0012 |
| Compound Name: | 1-[(3S)-7-(4-fluorophenyl)-3-methyl-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]-2-(pyridin-3-yl)ethan-1-one |
| Molecular Weight: | 376.43 |
| Molecular Formula: | C23 H21 F N2 O2 |
| Smiles: | C[C@H]1COc2ccc(cc2CN1C(Cc1cccnc1)=O)c1ccc(cc1)F |
| Stereo: | ABSOLUTE |
| logP: | 4.2368 |
| logD: | 4.2283 |
| logSw: | -4.1998 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.333 |
| InChI Key: | GSPKGXOISMAUDT-MRXNPFEDSA-N |