[(3S)-7-(3-fluorophenyl)-3-methyl-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl](oxan-4-yl)methanone
Chemical Structure Depiction of
[(3S)-7-(3-fluorophenyl)-3-methyl-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl](oxan-4-yl)methanone
[(3S)-7-(3-fluorophenyl)-3-methyl-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl](oxan-4-yl)methanone
Compound characteristics
| Compound ID: | SC09-0057 |
| Compound Name: | [(3S)-7-(3-fluorophenyl)-3-methyl-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl](oxan-4-yl)methanone |
| Molecular Weight: | 369.43 |
| Molecular Formula: | C22 H24 F N O3 |
| Smiles: | C[C@H]1COc2ccc(cc2CN1C(C1CCOCC1)=O)c1cccc(c1)F |
| Stereo: | ABSOLUTE |
| logP: | 4.5318 |
| logD: | 4.5318 |
| logSw: | -4.4316 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.443 |
| InChI Key: | XAHXXXMQHBXGIH-OAHLLOKOSA-N |