3-(benzoyloxy)-1-[2-(4-bromophenyl)-2-oxoethyl]-1-azabicyclo[2.2.2]octan-1-ium
Chemical Structure Depiction of
3-(benzoyloxy)-1-[2-(4-bromophenyl)-2-oxoethyl]-1-azabicyclo[2.2.2]octan-1-ium
3-(benzoyloxy)-1-[2-(4-bromophenyl)-2-oxoethyl]-1-azabicyclo[2.2.2]octan-1-ium
Compound characteristics
| Compound ID: | 8014-5575 |
| Compound Name: | 3-(benzoyloxy)-1-[2-(4-bromophenyl)-2-oxoethyl]-1-azabicyclo[2.2.2]octan-1-ium |
| Molecular Weight: | 509.24 |
| Molecular Formula: | C22 H23 Br N O3 |
| Salt: | Br- |
| Smiles: | C1C[N+]2(CCC1C(C2)OC(c1ccccc1)=O)CC(c1ccc(cc1)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3649 |
| logD: | 4.3649 |
| logSw: | -4.4066 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.709 |
| InChI Key: | WIHBBLOJXUMORN-LBVATQBMSA-N |