(2R)-3-benzylsulfanyl-2-[[2-[3-(4-chlorophenyl)-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-chlorophenyl)-5,9-dimethyl-7-oxofuro[3,2-g]chromen-6-yl]acetyl]amino]propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/365ec7ec9a5c406a91aca832e78297ab.png "(2R)-3-benzylsulfanyl-2-[[2-[3-(4-chlorophenyl)-5,9-dimethyl-7-oxofuro[3,2-g]chromen-6-yl]acetyl]amino]propanoic acid")
(2R)-3-benzylsulfanyl-2-[[2-[3-(4-chlorophenyl)-5,9-dimethyl-7-oxofuro[3,2-g]chromen-6-yl]acetyl]amino]propanoic acid
structure -
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CAS No:
956048-68-3
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Formula:
C31H26ClNO6S
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Chemical Name:
(2R)-3-benzylsulfanyl-2-[[2-[3-(4-chlorophenyl)-5,9-dimethyl-7-oxofuro[3,2-g]chromen-6-yl]acetyl]amino]propanoic acid
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Synonyms:
C31H26ClNO6S;ZINC2113723;STL531416;AKOS030501895;MCULE-7592695406;956048-68-3;S-benzyl-N-{[3-(4-chlorophenyl)-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-chlorophenyl)-5,9-dimethyl-7-oxofuro[3,2-g]chromen-6-yl]acetyl]amino]propanoic acid Basic Attributes
576.1 g/mol
575.1169364 g/mol
Computed Properties
Molecular Weight:576.1
XLogP3:5.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:575.1169364
Monoisotopic Mass:575.1169364
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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