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2222354-57-4

2222354-57-4 structural image
Product Name: HG-12-6
Formula: C29H27F3N6O2S
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COMPUTED DESCRIPTORS

Molecular Weight 580.6 g/mol
XLogP3 4.2
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 10
Rotatable Bond Count 7
Exact Mass 580.18682979 g/mol
Monoisotopic Mass 580.18682979 g/mol
Topological Polar Surface Area 128 Ų
Heavy Atom Count 41
Formal Charge 0
Complexity 933
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes