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77161-19-4

77161-19-4 structural image
Product Name: 2-Piperidinecarboxylic acid, 1-((6,8-dibromo-3,4-dihydro-4-oxo-3-pheny l-2-quinazolinyl)methyl)-
Formula: C21H19Br2N3O3
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COMPUTED DESCRIPTORS

Molecular Weight 521.2 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 4
Exact Mass 520.97727 g/mol
Monoisotopic Mass 518.97932 g/mol
Topological Polar Surface Area 73.2 Ų
Heavy Atom Count 29
Formal Charge 0
Complexity 668
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