4-[(7-acetamido-1-methylquinolin-1-ium-4-yl)amino]-N-[4-[(1-methylpyridin-1-ium-4-yl)amino]phenyl]benzamide;4-methylbenzenesulfonate
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![4-[(7-acetamido-1-methylquinolin-1-ium-4-yl)amino]-N-[4-[(1-methylpyridin-1-ium-4-yl)amino]phenyl]benzamide;4-methylbenzenesulfonate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/a7f1c7e764d64d6a93c0a2059bb06fef.png "4-[(7-acetamido-1-methylquinolin-1-ium-4-yl)amino]-N-[4-[(1-methylpyridin-1-ium-4-yl)amino]phenyl]benzamide;4-methylbenzenesulfonate")
4-[(7-acetamido-1-methylquinolin-1-ium-4-yl)amino]-N-[4-[(1-methylpyridin-1-ium-4-yl)amino]phenyl]benzamide;4-methylbenzenesulfonate
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CAS No:
50309-20-1
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Formula:
C45H44N6O8S2
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Chemical Name:
4-[(7-acetamido-1-methylquinolin-1-ium-4-yl)amino]-N-[4-[(1-methylpyridin-1-ium-4-yl)amino]phenyl]benzamide;4-methylbenzenesulfonate
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Synonyms:
50309-20-1;Quinolinium, 7-acetamido-1-methyl-4-(p-(p-((1-methylpyridinium-4-yl)amino)benzamido)anilino)-, di-p-toluenesulfonate;DTXSID30198328
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CAS No:
4-[(7-acetamido-1-methylquinolin-1-ium-4-yl)amino]-N-[4-[(1-methylpyridin-1-ium-4-yl)amino]phenyl]benzamide;4-methylbenzenesulfonate Basic Attributes
861.0 g/mol
860.26620473 g/mol
DTXSID30198328
Computed Properties
Molecular Weight:861.0
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:7
Exact Mass:860.26620473
Monoisotopic Mass:860.26620473
Topological Polar Surface Area:221
Heavy Atom Count:61
Complexity:994
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes
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