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N-(1-ethylquinolin-1-ium-6-yl)-4-[2-[(1-ethylquinolin-1-ium-6-yl)amino]-2-oxoethoxy]benzamide;4-methylbenzenesulfonate

N-(1-ethylquinolin-1-ium-6-yl)-4-[2-[(1-ethylquinolin-1-ium-6-yl)amino]-2-oxoethoxy]benzamide;4-methylbenzenesulfonate structure

CAS No:
18520-43-9
Formula:
C45H44N4O9S2
Chemical Name:
N-(1-ethylquinolin-1-ium-6-yl)-4-[2-[(1-ethylquinolin-1-ium-6-yl)amino]-2-oxoethoxy]benzamide;4-methylbenzenesulfonate
Synonyms:
18520-43-9;Quinolinium, 1-ethyl-6-(alpha-((1-ethylquinolinium-6-yl)carbamoyl)-p-anisamido)-, di-p-toluenesulfonate;CHEMBL3230597;DTXSID40171743

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N-(1-ethylquinolin-1-ium-6-yl)-4-[2-[(1-ethylquinolin-1-ium-6-yl)amino]-2-oxoethoxy]benzamide;4-methylbenzenesulfonate Basic Attributes

Molecular Weight：

849.0 g/mol

Exact Mass：

848.25497134 g/mol

DSSTox ID：

DTXSID40171743

Characteristics

PSA：

206 Å²

Computed Properties

Molecular Weight:849.0
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:8
Exact Mass:848.25497134
Monoisotopic Mass:848.25497134
Topological Polar Surface Area:206
Heavy Atom Count:60
Complexity:978
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes

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Guide of N-(1-ethylquinolin-1-ium-6-yl)-4-[2-[(1-ethylquinolin-1-ium-6-yl)amino]-2-oxoethoxy]benzamide;4-methylbenzenesulfonate

Basic Attributes
Characteristics
Computed Properties

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