RefChem:378790

2-N,5-N-bis(1-pentylquinolin-1-ium-6-yl)pyridine-2,5-dicarboxamide;bis(4-methylbenzenesulfonate)

Also Known As: Quinolinium, 6,6'-(2,5-pyridinediylbis(carbonylimino))bis(1-pentyl-, di-p-toluenesulfonate|Quinolinium, 6,6'-(pyridin-2,5-diylbis(carbonylimino))bis(1-pentyl-, ditosylate|6,6'-(Pyridin-2,5-diylbis(carbonylimino))bis(1-pentylquinolinium) ditosylate|2-N,5-N-bis(1-pentylquinolin-1-ium-6-yl)pyridine-2,5-dicarboxamide; 4-methylbenzenesulfonate|6,6'-[Pyridine-2,5-diylbis(carbonylazanediyl)]bis(1-pentylquinolin-1-ium) bis(4-methylbenzene-1-sulfonate)

Molecular Formula	C49H53N5O8S2
Molecular Weight	903.33356 g/mol
LogP	8.64624
Topological Polar Surface Area	210.0 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	9
Rotatable Bonds	12
Exact Mass	903.33356
Monoisotopic Mass	903.33356
Heavy Atoms	64
Complexity	1050.0

Chemical Identifiers

CAS Number	18519-69-2
SMILES	CCCCC[N+]1=CC=CC2=C1C=CC(=C2)NC(=O)C3=CN=C(C=C3)C(=O)NC4=CC5=C(C=C4)[N+](=CC=C5)CCCCC.CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-]
InChIKey	HQWMKSXAZDCEIH-UHFFFAOYSA-N