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Home > Encyclopedia > (4-ethyl-7-methyl-2-oxochromen-5-yl) (2S)-4-methylsulfanyl-2-(phenylmethoxycarbonylamino)butanoate

(4-ethyl-7-methyl-2-oxochromen-5-yl) (2S)-4-methylsulfanyl-2-(phenylmethoxycarbonylamino)butanoate

(4-ethyl-7-methyl-2-oxochromen-5-yl) (2S)-4-methylsulfanyl-2-(phenylmethoxycarbonylamino)butanoate structure

(4-ethyl-7-methyl-2-oxochromen-5-yl) (2S)-4-methylsulfanyl-2-(phenylmethoxycarbonylamino)butanoate 

structure
  • CAS No:

    957001-43-3

  • Formula:

    C25H27NO6S

  • Chemical Name:

    (4-ethyl-7-methyl-2-oxochromen-5-yl) (2S)-4-methylsulfanyl-2-(phenylmethoxycarbonylamino)butanoate

  • Synonyms:

    ZINC2092505;AKOS030497148;(S)-4-ethyl-7-methyl-2-oxo-2H-chromen-5-yl 2-(((benzyloxy)carbonyl)amino)-4-(methylthio)butanoate;957001-43-3

(4-ethyl-7-methyl-2-oxochromen-5-yl) (2S)-4-methylsulfanyl-2-(phenylmethoxycarbonylamino)butanoate Basic Attributes

469.6 g/mol

469.15590875 g/mol

Characteristics

116 Ų

Computed Properties

Molecular Weight:469.6
XLogP3:4.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:11
Exact Mass:469.15590875
Monoisotopic Mass:469.15590875
Topological Polar Surface Area:116
Heavy Atom Count:33
Complexity:720
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of (4-ethyl-7-methyl-2-oxochromen-5-yl) (2S)-4-methylsulfanyl-2-(phenylmethoxycarbonylamino)butanoate

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