(2S)-4-methylsulfanyl-2-(3-oxo-1H-isoindol-2-yl)butanoic acid
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(2S)-4-methylsulfanyl-2-(3-oxo-1H-isoindol-2-yl)butanoic acid
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CAS No:
1164523-75-4
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Formula:
C13H15NO3S
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Chemical Name:
(2S)-4-methylsulfanyl-2-(3-oxo-1H-isoindol-2-yl)butanoic acid
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Synonyms:
(S)-4-(methylthio)-2-(1-oxoisoindolin-2-yl)butanoic acid;1164523-75-4;SMR000097536;MLS000120693;CHEMBL1517017;HMS1625C13;HMS2242A23;ZINC2219991;EiM17-04069;AKOS001502956;CCG-131258;MCULE-3248475855;SR-01000105362;SR-01000105362-1;(2S)-4-methylsulfanyl-2-(3-oxo-1H-isoindol-2-yl)butanoic acid;(2S)-4-(methylthio)-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)butanoic acid
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CAS No:
(2S)-4-methylsulfanyl-2-(3-oxo-1H-isoindol-2-yl)butanoic acid Basic Attributes
265.33 g/mol
265.07726451 g/mol
Computed Properties
Molecular Weight:265.33
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:265.07726451
Monoisotopic Mass:265.07726451
Topological Polar Surface Area:82.9
Heavy Atom Count:18
Complexity:334
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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