4-methylbenzenesulfonate;2-methyl-1-N,4-N-bis[4-[(1-propylpyridin-1-ium-3-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide
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![4-methylbenzenesulfonate;2-methyl-1-N,4-N-bis[4-[(1-propylpyridin-1-ium-3-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/f93fc1c8634c45468348d53d5b2b6a97.png "4-methylbenzenesulfonate;2-methyl-1-N,4-N-bis[4-[(1-propylpyridin-1-ium-3-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide")
4-methylbenzenesulfonate;2-methyl-1-N,4-N-bis[4-[(1-propylpyridin-1-ium-3-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide
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CAS No:
16760-23-9
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Formula:
C53H54N6O10S2
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Chemical Name:
4-methylbenzenesulfonate;2-methyl-1-N,4-N-bis[4-[(1-propylpyridin-1-ium-3-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide
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Synonyms:
16760-23-9;Pyridinium, 3,3'-(2-methylterephthaloylbis(imino-p-phenylenecarbonylimino))bis(1-propyl-, di-p-toluenesulfonate;CHEMBL3230681;DTXSID00168336
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CAS No:
4-methylbenzenesulfonate;2-methyl-1-N,4-N-bis[4-[(1-propylpyridin-1-ium-3-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide Basic Attributes
999.2 g/mol
998.33428429 g/mol
DTXSID00168336
Computed Properties
Molecular Weight:999.2
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:12
Exact Mass:998.33428429
Monoisotopic Mass:998.33428429
Topological Polar Surface Area:255
Heavy Atom Count:71
Complexity:1280
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes
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