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2-methyl-1-oxido-3-thiophen-2-yl-6,7-dihydro-5H-cyclopenta[b]pyrazin-4-ium 4-oxide

2-methyl-1-oxido-3-thiophen-2-yl-6,7-dihydro-5H-cyclopenta[b]pyrazin-4-ium 4-oxide structure

CAS No:
88819-93-6
Formula:
C12H12N2O2S
Chemical Name:
2-methyl-1-oxido-3-thiophen-2-yl-6,7-dihydro-5H-cyclopenta[b]pyrazin-4-ium 4-oxide
Synonyms:
2-Methyl-3-thiophen-2-yl-6,7-dihydro-5H-cyclopentapyrazine 1,4-dioxide;CHEMBL1527420;HMS2339G20;ZINC2238538;CCG-21982;STK844302;AKOS000565490;EU-0047069;2-methyl-3-(thiophen-2-yl)-6,7-dihydro-5H-cyclopenta[b]pyrazine 1,4-dioxide;88819-93-6

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2-methyl-1-oxido-3-thiophen-2-yl-6,7-dihydro-5H-cyclopenta[b]pyrazin-4-ium 4-oxide Basic Attributes

Molecular Weight：

248.30 g/mol

Exact Mass：

248.06194880 g/mol

Characteristics

PSA：

74.6 Å²

XLogP3：

3.0692

Melting Point：

142 - 143 °C (ethyl acetate)

Computed Properties

Molecular Weight:248.30
XLogP3:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:248.06194880
Monoisotopic Mass:248.06194880
Topological Polar Surface Area:74.6
Heavy Atom Count:17
Complexity:442
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-methyl-1-oxido-3-thiophen-2-yl-6,7-dihydro-5H-cyclopenta[b]pyrazin-4-ium 4-oxide

Basic Attributes
Characteristics
Computed Properties
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