(2-oxochromen-7-yl) (2S)-4-methylsulfanyl-2-(phenylmethoxycarbonylamino)butanoate
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(2-oxochromen-7-yl) (2S)-4-methylsulfanyl-2-(phenylmethoxycarbonylamino)butanoate
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CAS No:
956181-25-2
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Formula:
C22H21NO6S
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Chemical Name:
(2-oxochromen-7-yl) (2S)-4-methylsulfanyl-2-(phenylmethoxycarbonylamino)butanoate
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Synonyms:
ZINC2094094;AKOS030497480;(S)-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)-4-(methylthio)butanoate;956181-25-2
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CAS No:
(2-oxochromen-7-yl) (2S)-4-methylsulfanyl-2-(phenylmethoxycarbonylamino)butanoate Basic Attributes
427.5 g/mol
427.10895856 g/mol
Computed Properties
Molecular Weight:427.5
XLogP3:3.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:10
Exact Mass:427.10895856
Monoisotopic Mass:427.10895856
Topological Polar Surface Area:116
Heavy Atom Count:30
Complexity:633
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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