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Homecas107745-64-2

107745-64-2

107745-64-2 structural image
Product Name: phthalidyltheophylline
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COMPUTED DESCRIPTORS

Molecular Weight 312.28 g/mol
XLogP3 0.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 1
Exact Mass 312.08585488 g/mol
Monoisotopic Mass 312.08585488 g/mol
Topological Polar Surface Area 84.7 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 568
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