4-methylbenzenesulfonate;4-[3-oxo-3-[(1-propylquinolin-1-ium-6-yl)amino]propyl]-N-(1-propylquinolin-1-ium-6-yl)benzamide
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![4-methylbenzenesulfonate;4-[3-oxo-3-[(1-propylquinolin-1-ium-6-yl)amino]propyl]-N-(1-propylquinolin-1-ium-6-yl)benzamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/26de51090e7c43998ef4806883ef04c9.png "4-methylbenzenesulfonate;4-[3-oxo-3-[(1-propylquinolin-1-ium-6-yl)amino]propyl]-N-(1-propylquinolin-1-ium-6-yl)benzamide")
4-methylbenzenesulfonate;4-[3-oxo-3-[(1-propylquinolin-1-ium-6-yl)amino]propyl]-N-(1-propylquinolin-1-ium-6-yl)benzamide
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CAS No:
18519-60-3
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Formula:
C48H50N4O8S2
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Chemical Name:
4-methylbenzenesulfonate;4-[3-oxo-3-[(1-propylquinolin-1-ium-6-yl)amino]propyl]-N-(1-propylquinolin-1-ium-6-yl)benzamide
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Synonyms:
Quinolinium, 1-propyl-6-(p-((1-propylquinolinium-6-yl)carbamoyl)hydrocinnamamido)-, di-p-toluenesulfonate;18519-60-3;Quinolinium, 6,6'-(alpha,p-phenethylenebis(carbonylimino))bis(1-propyl-, ditosylate;6,6'-(alpha,p-Phenethylenebis(carbonylimino))bis(1-propylquinolinium) ditosylate;CHEMBL3230603;DTXSID10171735;Quinolinium, 6-((1-oxo-3-(4-(((1-propylquinolinium-6-yl)amino)carbonyl)phenyl)propyl)amino)-1-propyl-, salt with 4-methylbenzenesulfonic acid (1:2)
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CAS No:
4-methylbenzenesulfonate;4-[3-oxo-3-[(1-propylquinolin-1-ium-6-yl)amino]propyl]-N-(1-propylquinolin-1-ium-6-yl)benzamide Basic Attributes
875.1 g/mol
874.30700691 g/mol
DTXSID10171735
Computed Properties
Molecular Weight:875.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:10
Exact Mass:874.30700691
Monoisotopic Mass:874.30700691
Topological Polar Surface Area:197
Heavy Atom Count:62
Complexity:1000
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes
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