(1RS)-1-{[(4-butoxy-3-methoxybenzoyl)oxy]methyl}-5-methyloctahydro-2H-quinolizin-5-ium--bromide (1/1)
Chemical Structure Depiction of
(1RS)-1-{[(4-butoxy-3-methoxybenzoyl)oxy]methyl}-5-methyloctahydro-2H-quinolizin-5-ium--bromide (1/1)
(1RS)-1-{[(4-butoxy-3-methoxybenzoyl)oxy]methyl}-5-methyloctahydro-2H-quinolizin-5-ium--bromide (1/1)
Compound characteristics
| Compound ID: | 3886-1256 |
| Compound Name: | (1RS)-1-{[(4-butoxy-3-methoxybenzoyl)oxy]methyl}-5-methyloctahydro-2H-quinolizin-5-ium--bromide (1/1) |
| Molecular Weight: | 470.45 |
| Molecular Formula: | C23 H36 N O4 |
| Salt: | Br- |
| Smiles: | CCCCOc1ccc(cc1OC)C(=O)OC[C@@H]1CCC[N+]2(C)CCCCC12 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.2368 |
| logD: | 4.2368 |
| logSw: | -4.2261 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.101 |
| InChI Key: | KZUFRLKJCLWSAW-KDARRYODSA-N |