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Homecas1803079-49-3

1803079-49-3

1803079-49-3 structural image
Product Name: Linagliptin N-Acetyl Impurity
Formula: C27H30N8O3
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COMPUTED DESCRIPTORS

Molecular Weight 514.6 g/mol
XLogP3 2.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 5
Exact Mass 514.24408685 g/mol
Monoisotopic Mass 514.24408685 g/mol
Topological Polar Surface Area 117 Ų
Heavy Atom Count 38
Formal Charge 0
Complexity 993
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes