1-[(3S)-7-(4-fluorophenyl)-3-methyl-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]ethan-1-one
Chemical Structure Depiction of
1-[(3S)-7-(4-fluorophenyl)-3-methyl-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]ethan-1-one
1-[(3S)-7-(4-fluorophenyl)-3-methyl-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]ethan-1-one
Compound characteristics
| Compound ID: | SC09-0031 |
| Compound Name: | 1-[(3S)-7-(4-fluorophenyl)-3-methyl-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]ethan-1-one |
| Molecular Weight: | 299.34 |
| Molecular Formula: | C18 H18 F N O2 |
| Smiles: | CC(N1Cc2cc(ccc2OC[C@@H]1C)c1ccc(cc1)F)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.8337 |
| logD: | 3.8337 |
| logSw: | -4.0719 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 25.0818 |
| InChI Key: | JQXXHYGVPDAUKT-GFCCVEGCSA-N |