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1228594-69-1

1228594-69-1 structural image
Product Name: YEJFOMBJSMKIIM-BVRKHOPBSA-N
Formula: C31H28BrClN2O
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COMPUTED DESCRIPTORS

Molecular Weight 559.9 g/mol
XLogP3 7.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 7
Exact Mass 558.10735 g/mol
Monoisotopic Mass 558.10735 g/mol
Topological Polar Surface Area 36.4 Ų
Heavy Atom Count 36
Formal Charge 0
Complexity 702
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes