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58447-18-0

58447-18-0 structural image
Product Name: 7,7-succinylditheophylline
Formula: C18H18N8O6
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COMPUTED DESCRIPTORS

Molecular Weight 442.4 g/mol
XLogP3 -1.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 3
Exact Mass 442.13493032 g/mol
Monoisotopic Mass 442.13493032 g/mol
Topological Polar Surface Area 151 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 838
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