RefChem:1097325

2-(3-hydroxypyridin-1-ium-1-yl)-1-[4-[4-[2-(3-hydroxypyridin-1-ium-1-yl)acetyl]phenyl]phenyl]ethanone dibromide

Also Known As: KST-1B2701|1,1'-(4,4'-Biphenylenebis(carbonylmethylene))bis(3-hydroxypyridinium bromide)|Pyridinium, 1,1'-(4,4'-biphenylenebis(carbonylmethylene))bis(3-hydroxy-, dibromide|1,1'-[biphenyl-4,4'-diylbis(2-oxoethane-2,1-diyl)]bis(3-hydroxypyridinium) dibromide|2-(3-hydroxypyridin-1-ium-1-yl)-1-[4-[4-[2-(3-hydroxypyridin-1-ium-1-yl)acetyl]phenyl]phenyl]ethanone dibromide|2-(3-hydroxypyridin-1-ium-1-yl)-1-[4-[4-[2-(3-hydroxypyridin-1-ium-1-yl)acetyl]phenyl]phenyl]ethanone,dibromide|e Pyridinium, 1,1a(2)-[[1,1a(2)-biphenyl]-4,4a(2)-diylbis(2-oxo-2,1-ethanediyl)]bis[3-hydroxy-, dibromide|Pyridinium,1,1'-[[1,1'-biphenyl]-4,4'-diylbis(2-oxo-2,1-ethanediyl)]bis[3-hydroxy-,dibromide (9CI)

Molecular Formula	C26H22Br2N2O4
Molecular Weight	583.9946 g/mol
LogP	-2.8864
Topological Polar Surface Area	82.4 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	7
Exact Mass	583.9946
Monoisotopic Mass	583.9946
Heavy Atoms	34
Complexity	571.0

Chemical Identifiers

CAS Number	2852-27-9
SMILES	C1=CC(=C[N+](=C1)CC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)C(=O)C[N+]4=CC=CC(=C4)O)O.[Br-].[Br-]
InChIKey	VCKOQDOTPSVUIU-UHFFFAOYSA-N