(3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoate
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![(3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/d377f72d92ee4983ad2215e3e44c2578.png "(3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoate")
(3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoate
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CAS No:
956324-92-8
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Formula:
C28H33NO6S
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Chemical Name:
(3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoate
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Synonyms:
ZINC2147747;AKOS030496655;(S)-3-benzyl-4,7-dimethyl-2-oxo-2H-chromen-5-yl 2-((tert-butoxycarbonyl)amino)-4-(methylthio)butanoate;956324-92-8
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CAS No:
(3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoate Basic Attributes
511.6 g/mol
511.20285895 g/mol
Computed Properties
Molecular Weight:511.6
XLogP3:5.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:11
Exact Mass:511.20285895
Monoisotopic Mass:511.20285895
Topological Polar Surface Area:116
Heavy Atom Count:36
Complexity:828
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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