2,3-dimethyl-1-N,4-N-bis[4-[(1-methylpyridin-1-ium-3-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide;4-methylbenzenesulfonate
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![2,3-dimethyl-1-N,4-N-bis[4-[(1-methylpyridin-1-ium-3-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide;4-methylbenzenesulfonate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/3a592d227f8645de8901015ea7cce364.png "2,3-dimethyl-1-N,4-N-bis[4-[(1-methylpyridin-1-ium-3-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide;4-methylbenzenesulfonate")
2,3-dimethyl-1-N,4-N-bis[4-[(1-methylpyridin-1-ium-3-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide;4-methylbenzenesulfonate
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CAS No:
23617-47-2
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Formula:
C50H48N6O10S2
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Chemical Name:
2,3-dimethyl-1-N,4-N-bis[4-[(1-methylpyridin-1-ium-3-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide;4-methylbenzenesulfonate
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Synonyms:
SN 6330;CHEMBL3230666;Pyridinium, 3,3'-((2,3-dimethyl-1,4-phenylene)bis(carbonylimino-4,1-phenylenecarbonylimino))bis(1-methyl-, salt with 4-methylbenzenesulfonic acid (1:2);Pyridinium, 3,3'-((2,3-dimethylterephthaloyl)bis(imino-p-phenylenecarbonylimino))bis(1-methyl-, di-p-toluenesulfonate;23617-47-2
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CAS No:
2,3-dimethyl-1-N,4-N-bis[4-[(1-methylpyridin-1-ium-3-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide;4-methylbenzenesulfonate Basic Attributes
957.1 g/mol
956.28733410 g/mol
Computed Properties
Molecular Weight:957.1
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:8
Exact Mass:956.28733410
Monoisotopic Mass:956.28733410
Topological Polar Surface Area:255
Heavy Atom Count:68
Complexity:1170
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes
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