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845674-84-2

845674-84-2 structural image
Product Name: SC-558
Formula: C16H11BrF3N3O2S
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COMPUTED DESCRIPTORS

Molecular Weight 446.2 g/mol
XLogP3 3.7
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 3
Exact Mass 444.97074 g/mol
Monoisotopic Mass 444.97074 g/mol
Topological Polar Surface Area 86.4 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 583
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