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1675201-14-5

1675201-14-5 structural image
Product Name: Sitagliptin IMpurity
Formula: C16H12F6N4O
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COMPUTED DESCRIPTORS

Molecular Weight 390.28 g/mol
XLogP3 1.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 3
Exact Mass 390.09152999 g/mol
Monoisotopic Mass 390.09152999 g/mol
Topological Polar Surface Area 51 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 574
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 1
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes