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1228108-65-3

1228108-65-3 structural image
Product Name: BI-97C1
Formula: C42H40N2O8
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COMPUTED DESCRIPTORS

Molecular Weight 700.8 g/mol
XLogP3 8.9
Hydrogen Bond Donor Count 8
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 9
Exact Mass 700.27846624 g/mol
Monoisotopic Mass 700.27846624 g/mol
Topological Polar Surface Area 180 Ų
Heavy Atom Count 52
Formal Charge 0
Complexity 1100
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes