(4-ethyl-8-methyl-2-oxochromen-7-yl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoate
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![(4-ethyl-8-methyl-2-oxochromen-7-yl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/63fd6a84e09b493eaa588319842ae8d0.png "(4-ethyl-8-methyl-2-oxochromen-7-yl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoate")
(4-ethyl-8-methyl-2-oxochromen-7-yl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoate
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CAS No:
956045-21-9
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Formula:
C22H29NO6S
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Chemical Name:
(4-ethyl-8-methyl-2-oxochromen-7-yl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoate
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Synonyms:
ZINC2094823;AKOS030497648;(S)-4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-4-(methylthio)butanoate;956045-21-9
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CAS No:
(4-ethyl-8-methyl-2-oxochromen-7-yl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoate Basic Attributes
435.5 g/mol
435.17155882 g/mol
Computed Properties
Molecular Weight:435.5
XLogP3:4.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:10
Exact Mass:435.17155882
Monoisotopic Mass:435.17155882
Topological Polar Surface Area:116
Heavy Atom Count:30
Complexity:671
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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