1-N,4-N-bis[3-methoxy-4-[(1-methylpyridin-1-ium-3-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide;4-methylbenzenesulfonate
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1-N,4-N-bis[3-methoxy-4-[(1-methylpyridin-1-ium-3-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide;4-methylbenzenesulfonate
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CAS No:
19083-87-5
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Formula:
C50H48N6O12S2
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Chemical Name:
1-N,4-N-bis[3-methoxy-4-[(1-methylpyridin-1-ium-3-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide;4-methylbenzenesulfonate
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Synonyms:
19083-87-5;Pyridinium, 3,3'-(terephthaloylbis(imino(2-methoxy-p-phenylene)carbonylimino))bis(1-methyl-, di-p-toluenesulfonate;CHEMBL3230695;DTXSID50172589
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CAS No:
1-N,4-N-bis[3-methoxy-4-[(1-methylpyridin-1-ium-3-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide;4-methylbenzenesulfonate Basic Attributes
989.1 g/mol
988.27716333 g/mol
DTXSID50172589
Computed Properties
Molecular Weight:989.1
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:10
Exact Mass:988.27716333
Monoisotopic Mass:988.27716333
Topological Polar Surface Area:274
Heavy Atom Count:70
Complexity:1210
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes
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