(2R)-3-benzylsulfanyl-2-[[2-(7-methoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]propanoic acid
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![(2R)-3-benzylsulfanyl-2-[[2-(7-methoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/cd13bd5651834c459485c15632d0c736.png "(2R)-3-benzylsulfanyl-2-[[2-(7-methoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]propanoic acid")
(2R)-3-benzylsulfanyl-2-[[2-(7-methoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]propanoic acid
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CAS No:
956045-75-3
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Formula:
C23H23NO6S
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Chemical Name:
(2R)-3-benzylsulfanyl-2-[[2-(7-methoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]propanoic acid
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Synonyms:
ZINC2103648;AKOS030499486;MCULE-4884632728;(R)-3-(benzylthio)-2-(2-(7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid;956045-75-3
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CAS No:
(2R)-3-benzylsulfanyl-2-[[2-(7-methoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]propanoic acid Basic Attributes
441.5 g/mol
441.12460863 g/mol
Computed Properties
Molecular Weight:441.5
XLogP3:2.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:441.12460863
Monoisotopic Mass:441.12460863
Topological Polar Surface Area:127
Heavy Atom Count:31
Complexity:702
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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