(2R)-3-benzylsulfanyl-2-[[2-[3-(4-fluorophenyl)-5,9-dimethyl-7-oxofuro[3,2-g]chromen-6-yl]acetyl]amino]propanoic acid
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![(2R)-3-benzylsulfanyl-2-[[2-[3-(4-fluorophenyl)-5,9-dimethyl-7-oxofuro[3,2-g]chromen-6-yl]acetyl]amino]propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/504049c770d248a98a65cf0d7c6efe27.png "(2R)-3-benzylsulfanyl-2-[[2-[3-(4-fluorophenyl)-5,9-dimethyl-7-oxofuro[3,2-g]chromen-6-yl]acetyl]amino]propanoic acid")
(2R)-3-benzylsulfanyl-2-[[2-[3-(4-fluorophenyl)-5,9-dimethyl-7-oxofuro[3,2-g]chromen-6-yl]acetyl]amino]propanoic acid
structure -
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CAS No:
956044-16-9
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Formula:
C31H26FNO6S
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Chemical Name:
(2R)-3-benzylsulfanyl-2-[[2-[3-(4-fluorophenyl)-5,9-dimethyl-7-oxofuro[3,2-g]chromen-6-yl]acetyl]amino]propanoic acid
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Synonyms:
CHEMBL4633420;C31H26FNO6S;ZINC2120061;BDBM50540224;STL530218;AKOS030503040;MCULE-4202443403;956044-16-9;S-benzyl-N-{[3-(4-fluorophenyl)-5,9-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl]acetyl}-L-cysteine
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CAS No:
(2R)-3-benzylsulfanyl-2-[[2-[3-(4-fluorophenyl)-5,9-dimethyl-7-oxofuro[3,2-g]chromen-6-yl]acetyl]amino]propanoic acid Basic Attributes
559.6 g/mol
559.14648688 g/mol
Computed Properties
Molecular Weight:559.6
XLogP3:5.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:9
Exact Mass:559.14648688
Monoisotopic Mass:559.14648688
Topological Polar Surface Area:131
Heavy Atom Count:40
Complexity:975
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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