2-(3-fluorophenyl)-1-[1'-(propan-2-yl)-3H-spiro[[1,4]benzoxazepine-2,4'-piperidin]-4(5H)-yl]ethan-1-one
Chemical Structure Depiction of
2-(3-fluorophenyl)-1-[1'-(propan-2-yl)-3H-spiro[[1,4]benzoxazepine-2,4'-piperidin]-4(5H)-yl]ethan-1-one
2-(3-fluorophenyl)-1-[1'-(propan-2-yl)-3H-spiro[[1,4]benzoxazepine-2,4'-piperidin]-4(5H)-yl]ethan-1-one
Compound characteristics
| Compound ID: | S530-0188 |
| Compound Name: | 2-(3-fluorophenyl)-1-[1'-(propan-2-yl)-3H-spiro[[1,4]benzoxazepine-2,4'-piperidin]-4(5H)-yl]ethan-1-one |
| Molecular Weight: | 396.5 |
| Molecular Formula: | C24 H29 F N2 O2 |
| Smiles: | CC(C)N1CCC2(CC1)CN(Cc1ccccc1O2)C(Cc1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2934 |
| logD: | 1.4976 |
| logSw: | -4.4445 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 25.9648 |
| InChI Key: | NEBGYYZTERMQEI-UHFFFAOYSA-N |