PK-154
trimethyl-[2-[3-[4-[3-oxo-3-[2-(trimethylazaniumyl)ethoxy]propyl]phenyl]propanoyloxy]ethyl]azanium diiodide
Also Known As: PK-154|2,2'-(1,4-Phenylenebis(1-oxo-3,1-propanediyl)oxy)bis(N,N,N-trimethylethanaminium) diiodide|2,2'-{benzene-1,4-diylbis[(1-oxopropane-3,1-diyl)oxy]}bis(n,n,n-trimethylethanaminium) diiodide|trimethyl-[2-[3-[4-[3-oxo-3-[2-(trimethylazaniumyl)ethoxy]propyl]phenyl]propanoyloxy]ethyl]azanium;diiodide|2,2'-{1,4-Phenylenebis[(1-oxopropane-3,1-diyl)oxy]}bis(N,N,N-trimethylethan-1-aminium) diiodide|Ethanaminium, 2,2'-(1,4-phenylenebis((1-oxo-3,1-propanediyl)oxy))bis(N,N,N-trimethyl)-, diiodide|Ethanaminium, 2,2'-(1,4-phenylenebis((1-oxo-3,1-propanediyl)oxy))bis(N,N,N-trimethyl-, diiodide|trimethyl-[2-[3-[4-[3-oxo-3-[2-(trimethylazaniumyl)ethoxy]propyl]phenyl]propanoyloxy]ethyl]azanium diiodide
| Molecular Formula | C22H38I2N2O4 |
|---|---|
| Molecular Weight | 648.0921 g/mol |
| LogP | -3.9414 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 14 |
| Exact Mass | 648.0921 |
| Monoisotopic Mass | 648.0921 |
| Heavy Atoms | 30 |
| Complexity | 428.0 |
Chemical Identifiers
| CAS Number | 4368-75-6 |
|---|---|
| SMILES | C[N+](C)(C)CCOC(=O)CCC1=CC=C(C=C1)CCC(=O)OCC[N+](C)(C)C.[I-].[I-] |
| InChIKey | ZOWMDIDUGVRIKO-UHFFFAOYSA-L |
Product Overview
PK-154 (CAS 4368-75-6), with molecular formula C22H38I2N2O4 and molecular weight 648.0921 g/mol. IUPAC: trimethyl-[2-[3-[4-[3-oxo-3-[2-(trimethylazaniumyl)ethoxy]propyl]phenyl]propanoyloxy]ethyl]azanium diiodide.