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1384439-79-5

1384439-79-5 structural image
Product Name: (S)-N-(2-(1-(3,4-dihydroxyphenyl)-2-(methylsulfonyl)ethyl)-1,3-dioxoisoindolin-4-yl)acetamide
Formula: C19H18N2O7S
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COMPUTED DESCRIPTORS

Molecular Weight 418.4 g/mol
XLogP3 0.8
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 5
Exact Mass 418.08347209 g/mol
Monoisotopic Mass 418.08347209 g/mol
Topological Polar Surface Area 150 Ų
Heavy Atom Count 29
Formal Charge 0
Complexity 778
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes