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1-(2,5-dimethyl-1-phenylpyrrol-3-yl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanylethanone

1-(2,5-dimethyl-1-phenylpyrrol-3-yl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanylethanone structure

CAS No:
731780-92-0
Formula:
C19H18N2O2S
Chemical Name:
1-(2,5-dimethyl-1-phenylpyrrol-3-yl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanylethanone
Synonyms:
MLS000770655;SMR000343845;CHEMBL1540747;cid_2453287;BDBM115030;HMS2698J15;ZINC3337072;AKOS017003816;1-(2,5-dimethyl-1-phenylpyrrol-3-yl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanylethanone;Z18545722;1-(2,5-dimethyl-1-phenyl-3-pyrrolyl)-2-[(1-oxido-2-pyridin-1-iumyl)thio]ethanone;1-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanone;1-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-2-[(1-oxidopyridin-1-ium-2-yl)thio]ethanone;2-{[2-(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)-2-oxoethyl]sulfanyl}pyridin-1-ium-1-olate;731780-92-0

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1-(2,5-dimethyl-1-phenylpyrrol-3-yl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanylethanone Basic Attributes

Molecular Weight：

338.4 g/mol

Exact Mass：

338.10889899 g/mol

Characteristics

PSA：

72.8 Å²

Computed Properties

Molecular Weight:338.4
XLogP3:3.3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:338.10889899
Monoisotopic Mass:338.10889899
Topological Polar Surface Area:72.8
Heavy Atom Count:24
Complexity:428
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(2,5-dimethyl-1-phenylpyrrol-3-yl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanylethanone

Basic Attributes
Characteristics
Computed Properties

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