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1-N,4-N-bis[4-[(1-ethylpyridin-1-ium-3-yl)carbamoyl]phenyl]-2-methylbenzene-1,4-dicarboxamide;4-methylbenzenesulfonate

1-N,4-N-bis[4-[(1-ethylpyridin-1-ium-3-yl)carbamoyl]phenyl]-2-methylbenzene-1,4-dicarboxamide;4-methylbenzenesulfonate structure

CAS No:
16760-22-8
Formula:
C51H50N6O10S2
Chemical Name:
1-N,4-N-bis[4-[(1-ethylpyridin-1-ium-3-yl)carbamoyl]phenyl]-2-methylbenzene-1,4-dicarboxamide;4-methylbenzenesulfonate
Synonyms:
16760-22-8;Pyridinium, 3,3'-(2-methylterephthaloylbis(imino-p-phenylenecarbonylimino))bis(1-ethyl-, di-p-toluenesulfonate;CHEMBL3230680;DTXSID40168335

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1-N,4-N-bis[4-[(1-ethylpyridin-1-ium-3-yl)carbamoyl]phenyl]-2-methylbenzene-1,4-dicarboxamide;4-methylbenzenesulfonate Basic Attributes

Molecular Weight：

971.1 g/mol

Exact Mass：

970.30298416 g/mol

DSSTox ID：

DTXSID40168335

Characteristics

PSA：

255 Å²

Computed Properties

Molecular Weight:971.1
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:10
Exact Mass:970.30298416
Monoisotopic Mass:970.30298416
Topological Polar Surface Area:255
Heavy Atom Count:69
Complexity:1250
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes

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Guide of 1-N,4-N-bis[4-[(1-ethylpyridin-1-ium-3-yl)carbamoyl]phenyl]-2-methylbenzene-1,4-dicarboxamide;4-methylbenzenesulfonate

Basic Attributes
Characteristics
Computed Properties

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