(2R)-3-benzylsulfanyl-2-[[2-(4-ethyl-2-oxochromen-7-yl)oxyacetyl]amino]propanoic acid
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![(2R)-3-benzylsulfanyl-2-[[2-(4-ethyl-2-oxochromen-7-yl)oxyacetyl]amino]propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/e891074d90ab4090affe0b1b7fa614c1.png "(2R)-3-benzylsulfanyl-2-[[2-(4-ethyl-2-oxochromen-7-yl)oxyacetyl]amino]propanoic acid")
(2R)-3-benzylsulfanyl-2-[[2-(4-ethyl-2-oxochromen-7-yl)oxyacetyl]amino]propanoic acid
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CAS No:
956691-19-3
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Formula:
C23H23NO6S
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Chemical Name:
(2R)-3-benzylsulfanyl-2-[[2-(4-ethyl-2-oxochromen-7-yl)oxyacetyl]amino]propanoic acid
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Synonyms:
ZINC2123060;STL531094;AKOS030504029;MCULE-6749019290;S-benzyl-N-{[(4-ethyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}-L-cysteine;(R)-3-(benzylthio)-2-(2-((4-ethyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)propanoic acid;956691-19-3
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CAS No:
(2R)-3-benzylsulfanyl-2-[[2-(4-ethyl-2-oxochromen-7-yl)oxyacetyl]amino]propanoic acid Basic Attributes
441.5 g/mol
441.12460863 g/mol
Computed Properties
Molecular Weight:441.5
XLogP3:3.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:10
Exact Mass:441.12460863
Monoisotopic Mass:441.12460863
Topological Polar Surface Area:127
Heavy Atom Count:31
Complexity:675
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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