1-[2-(4-bromophenyl)-2-oxoethyl]-3-(diphenylmethylidene)-1-azabicyclo[2.2.2]octan-1-ium--bromide (1/1)
Chemical Structure Depiction of
1-[2-(4-bromophenyl)-2-oxoethyl]-3-(diphenylmethylidene)-1-azabicyclo[2.2.2]octan-1-ium--bromide (1/1)
1-[2-(4-bromophenyl)-2-oxoethyl]-3-(diphenylmethylidene)-1-azabicyclo[2.2.2]octan-1-ium--bromide (1/1)
Compound characteristics
| Compound ID: | 8014-5567 |
| Compound Name: | 1-[2-(4-bromophenyl)-2-oxoethyl]-3-(diphenylmethylidene)-1-azabicyclo[2.2.2]octan-1-ium--bromide (1/1) |
| Molecular Weight: | 553.34 |
| Molecular Formula: | C28 H27 Br N O |
| Salt: | Br- |
| Smiles: | C1C[N+]2(CCC1C(C2)=C(c1ccccc1)c1ccccc1)CC(c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 6.2433 |
| logD: | 6.2433 |
| logSw: | -6.0837 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 13.3313 |
| InChI Key: | ACAPVJTWPOZMOW-UHFFFAOYSA-N |