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139308-65-9

139308-65-9 structural image
Product Name: Tolafentrine
Formula: C28H31N3O4S
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COMPUTED DESCRIPTORS

Molecular Weight 505.6 g/mol
XLogP3 4.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 6
Exact Mass 505.20352765 g/mol
Monoisotopic Mass 505.20352765 g/mol
Topological Polar Surface Area 88.6 Ų
Heavy Atom Count 36
Formal Charge 0
Complexity 874
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