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1-[1-[4-(difluoromethoxy)phenyl]-2,5-dimethylpyrrol-3-yl]-2-(1-oxidopyridin-1-ium-2-yl)sulfanylethanone

1-[1-[4-(difluoromethoxy)phenyl]-2,5-dimethylpyrrol-3-yl]-2-(1-oxidopyridin-1-ium-2-yl)sulfanylethanone structure

CAS No:
571162-07-7
Formula:
C20H18F2N2O3S
Chemical Name:
1-[1-[4-(difluoromethoxy)phenyl]-2,5-dimethylpyrrol-3-yl]-2-(1-oxidopyridin-1-ium-2-yl)sulfanylethanone
Synonyms:
MLS001033619;CHEMBL1536332;HMS2747L12;ZINC3283126;AKOS001076699;SMR000363968;Z18545630;2-[(2-{1-[4-(difluoromethoxy)phenyl]-2,5-dimethyl-1H-pyrrol-3-yl}-2-oxoethyl)sulfanyl]pyridin-1-ium-1-olate;571162-07-7

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1-[1-[4-(difluoromethoxy)phenyl]-2,5-dimethylpyrrol-3-yl]-2-(1-oxidopyridin-1-ium-2-yl)sulfanylethanone Basic Attributes

Molecular Weight：

404.4 g/mol

Exact Mass：

404.10061994 g/mol

Characteristics

PSA：

82 Å²

Computed Properties

Molecular Weight:404.4
XLogP3:4.2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:404.10061994
Monoisotopic Mass:404.10061994
Topological Polar Surface Area:82
Heavy Atom Count:28
Complexity:520
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-[1-[4-(difluoromethoxy)phenyl]-2,5-dimethylpyrrol-3-yl]-2-(1-oxidopyridin-1-ium-2-yl)sulfanylethanone

Basic Attributes
Characteristics
Computed Properties

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