 Home > Encyclopedia > 4-methylbenzenesulfonate;1-N-[4-[(1-methylpyridin-1-ium-3-yl)carbamoyl]phenyl]-4-N-(1-methylquinolin-1-ium-6-yl)benzene-1,4-dicarboxamide

4-methylbenzenesulfonate;1-N-[4-[(1-methylpyridin-1-ium-3-yl)carbamoyl]phenyl]-4-N-(1-methylquinolin-1-ium-6-yl)benzene-1,4-dicarboxamide

4-methylbenzenesulfonate;1-N-[4-[(1-methylpyridin-1-ium-3-yl)carbamoyl]phenyl]-4-N-(1-methylquinolin-1-ium-6-yl)benzene-1,4-dicarboxamide structure

CAS No:
19060-32-3
Formula:
C45H41N5O9S2
Chemical Name:
4-methylbenzenesulfonate;1-N-[4-[(1-methylpyridin-1-ium-3-yl)carbamoyl]phenyl]-4-N-(1-methylquinolin-1-ium-6-yl)benzene-1,4-dicarboxamide
Synonyms:
19060-32-3;Quinolinium, 1-methyl-6-((p-(p-((1-methylpyridinium-3-yl)carbamoyl)phenyl)carbamoyl)benzamido)-, di-p-toluenesulfonate;CHEMBL3230614;DTXSID50172544

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4-methylbenzenesulfonate;1-N-[4-[(1-methylpyridin-1-ium-3-yl)carbamoyl]phenyl]-4-N-(1-methylquinolin-1-ium-6-yl)benzene-1,4-dicarboxamide Basic Attributes

Molecular Weight：

860.0 g/mol

Exact Mass：

859.23457025 g/mol

DSSTox ID：

DTXSID50172544

Characteristics

PSA：

226 Å²

Computed Properties

Molecular Weight:860.0
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:6
Exact Mass:859.23457025
Monoisotopic Mass:859.23457025
Topological Polar Surface Area:226
Heavy Atom Count:61
Complexity:1040
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes

Hot Searches: anagen; dapoxetine; tbuoh; oxychem; furfural; propenoic acid

Guide of 4-methylbenzenesulfonate;1-N-[4-[(1-methylpyridin-1-ium-3-yl)carbamoyl]phenyl]-4-N-(1-methylquinolin-1-ium-6-yl)benzene-1,4-dicarboxamide

Basic Attributes
Characteristics
Computed Properties

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