1-[2-(4-bromophenyl)-2-oxoethyl]-3-[hydroxy(diphenyl)methyl]-1-azabicyclo[2.2.2]octan-1-ium--bromide (1/1)
Chemical Structure Depiction of
1-[2-(4-bromophenyl)-2-oxoethyl]-3-[hydroxy(diphenyl)methyl]-1-azabicyclo[2.2.2]octan-1-ium--bromide (1/1)
1-[2-(4-bromophenyl)-2-oxoethyl]-3-[hydroxy(diphenyl)methyl]-1-azabicyclo[2.2.2]octan-1-ium--bromide (1/1)
Compound characteristics
| Compound ID: | 4286-0111 |
| Compound Name: | 1-[2-(4-bromophenyl)-2-oxoethyl]-3-[hydroxy(diphenyl)methyl]-1-azabicyclo[2.2.2]octan-1-ium--bromide (1/1) |
| Molecular Weight: | 571.35 |
| Molecular Formula: | C28 H29 Br N O2 |
| Salt: | Br- |
| Smiles: | C1C[N+]2(CCC1C(C2)C(c1ccccc1)(c1ccccc1)O)CC(c1ccc(cc1)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4926 |
| logD: | 5.4926 |
| logSw: | -5.6509 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 28.3995 |
| InChI Key: | JHQFDHSPOYHZMH-GGZQPEMISA-N |