(2R)-3-benzylsulfanyl-2-[[2-[3-(4-fluorophenyl)-5-methyl-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-methyl-7-oxofuro[3,2-g]chromen-6-yl]acetyl]amino]propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/4a8ac2a4c39c4b9db5f20081dd70b204.png "(2R)-3-benzylsulfanyl-2-[[2-[3-(4-fluorophenyl)-5-methyl-7-oxofuro[3,2-g]chromen-6-yl]acetyl]amino]propanoic acid")
(2R)-3-benzylsulfanyl-2-[[2-[3-(4-fluorophenyl)-5-methyl-7-oxofuro[3,2-g]chromen-6-yl]acetyl]amino]propanoic acid
structure -
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CAS No:
957043-07-1
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Formula:
C30H24FNO6S
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Chemical Name:
(2R)-3-benzylsulfanyl-2-[[2-[3-(4-fluorophenyl)-5-methyl-7-oxofuro[3,2-g]chromen-6-yl]acetyl]amino]propanoic acid
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Synonyms:
C30H24FNO6S;ZINC2113376;EiM07-20388;AKOS030501819;MCULE-9425668147;957043-07-1
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CAS No:
(2R)-3-benzylsulfanyl-2-[[2-[3-(4-fluorophenyl)-5-methyl-7-oxofuro[3,2-g]chromen-6-yl]acetyl]amino]propanoic acid Basic Attributes
545.6 g/mol
545.13083682 g/mol
Computed Properties
Molecular Weight:545.6
XLogP3:4.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:9
Exact Mass:545.13083682
Monoisotopic Mass:545.13083682
Topological Polar Surface Area:131
Heavy Atom Count:39
Complexity:944
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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