3-methoxy-1-[1'-(propan-2-yl)-3H-spiro[[1,4]benzoxazepine-2,4'-piperidin]-4(5H)-yl]propan-1-one
Chemical Structure Depiction of
3-methoxy-1-[1'-(propan-2-yl)-3H-spiro[[1,4]benzoxazepine-2,4'-piperidin]-4(5H)-yl]propan-1-one
3-methoxy-1-[1'-(propan-2-yl)-3H-spiro[[1,4]benzoxazepine-2,4'-piperidin]-4(5H)-yl]propan-1-one
Compound characteristics
| Compound ID: | S530-0205 |
| Compound Name: | 3-methoxy-1-[1'-(propan-2-yl)-3H-spiro[[1,4]benzoxazepine-2,4'-piperidin]-4(5H)-yl]propan-1-one |
| Molecular Weight: | 346.47 |
| Molecular Formula: | C20 H30 N2 O3 |
| Smiles: | CC(C)N1CCC2(CC1)CN(Cc1ccccc1O2)C(CCOC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3195 |
| logD: | -0.4763 |
| logSw: | -2.5458 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.579 |
| InChI Key: | XXEKSAWPMLSBGK-UHFFFAOYSA-N |