 Home > Encyclopedia > 4-methylbenzenesulfonate;1-N-[4-[(1-propylquinolin-1-ium-6-carbonyl)amino]phenyl]-4-N-(1-propylquinolin-1-ium-6-yl)benzene-1,4-dicarboxamide

4-methylbenzenesulfonate;1-N-[4-[(1-propylquinolin-1-ium-6-carbonyl)amino]phenyl]-4-N-(1-propylquinolin-1-ium-6-yl)benzene-1,4-dicarboxamide

4-methylbenzenesulfonate;1-N-[4-[(1-propylquinolin-1-ium-6-carbonyl)amino]phenyl]-4-N-(1-propylquinolin-1-ium-6-yl)benzene-1,4-dicarboxamide structure

CAS No:
19056-08-7
Formula:
C53H51N5O9S2
Chemical Name:
4-methylbenzenesulfonate;1-N-[4-[(1-propylquinolin-1-ium-6-carbonyl)amino]phenyl]-4-N-(1-propylquinolin-1-ium-6-yl)benzene-1,4-dicarboxamide
Synonyms:
19056-08-7;Quinolinium, 1-propyl-6-((p-(p-((1-propylquinolinium-6-yl)carbamoyl)benzamido)phenyl)carbamoyl)-, di-p-toluenesulfonate;CHEMBL3230630;DTXSID20172536

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4-methylbenzenesulfonate;1-N-[4-[(1-propylquinolin-1-ium-6-carbonyl)amino]phenyl]-4-N-(1-propylquinolin-1-ium-6-yl)benzene-1,4-dicarboxamide Basic Attributes

Molecular Weight：

966.1 g/mol

Exact Mass：

965.31282057 g/mol

DSSTox ID：

DTXSID20172536

Characteristics

PSA：

226 Å²

Computed Properties

Molecular Weight:966.1
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:10
Exact Mass:965.31282057
Monoisotopic Mass:965.31282057
Topological Polar Surface Area:226
Heavy Atom Count:69
Complexity:1230
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes

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Guide of 4-methylbenzenesulfonate;1-N-[4-[(1-propylquinolin-1-ium-6-carbonyl)amino]phenyl]-4-N-(1-propylquinolin-1-ium-6-yl)benzene-1,4-dicarboxamide

Basic Attributes
Characteristics
Computed Properties

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