2-[(2H-1,3-benzodioxol-5-yl)methylidene]-1-azabicyclo[2.2.2]octan-3-one
Chemical Structure Depiction of
2-[(2H-1,3-benzodioxol-5-yl)methylidene]-1-azabicyclo[2.2.2]octan-3-one
2-[(2H-1,3-benzodioxol-5-yl)methylidene]-1-azabicyclo[2.2.2]octan-3-one
Compound characteristics
| Compound ID: | 3931-3290 |
| Compound Name: | 2-[(2H-1,3-benzodioxol-5-yl)methylidene]-1-azabicyclo[2.2.2]octan-3-one |
| Molecular Weight: | 257.29 |
| Molecular Formula: | C15 H15 N O3 |
| Smiles: | C1CN2CCC1C(/C2=C\c1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5898 |
| logD: | 0.1569 |
| logSw: | -2.9925 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.776 |
| InChI Key: | NGNUATHUAAONSD-KPKJPENVSA-N |