6-benzylsulfanyl-5-cyano-2-oxo-1H-pyridine-3-carboxylic acid
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6-benzylsulfanyl-5-cyano-2-oxo-1H-pyridine-3-carboxylic acid
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CAS No:
384356-93-8
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Formula:
C14H10N2O3S
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Chemical Name:
6-benzylsulfanyl-5-cyano-2-oxo-1H-pyridine-3-carboxylic acid
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Synonyms:
ZINC4813175;6-Benzylsulfanyl-5-cyano-2-oxo-1,2-dihydro-pyridine-3-carboxylic acid;STL332367;AKOS022132304;MCULE-9146701527;384356-93-8;6-(benzylthio)-5-cyano-2-oxo-1,2-dihydropyridine-3-carboxylic acid;6-(Benzylsulfanyl)-5-cyano-2-oxo-1,2-dihydro-3-pyridinecarboxylic acid #;6-(benzylsulfanyl)-5-cyano-2-oxo-1,2-dihydropyridine-3-carboxylic acid
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CAS No:
6-benzylsulfanyl-5-cyano-2-oxo-1H-pyridine-3-carboxylic acid Basic Attributes
286.31 g/mol
286.04121336 g/mol
Computed Properties
Molecular Weight:286.31
XLogP3:2.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:286.04121336
Monoisotopic Mass:286.04121336
Topological Polar Surface Area:116
Heavy Atom Count:20
Complexity:536
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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