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452290-48-1

452290-48-1 structural image
Product Name: 4-[3,4-bis(benzyloxy)phenyl]-1,4-dihydro[1,3,5]triazino[1,2-a]benzimidazol-2-amine
Formula: C29H25N5O2
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COMPUTED DESCRIPTORS

Molecular Weight 475.5 g/mol
XLogP3 4.9
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 7
Exact Mass 475.20082506 g/mol
Monoisotopic Mass 475.20082506 g/mol
Topological Polar Surface Area 86.7 Ų
Heavy Atom Count 36
Formal Charge 0
Complexity 737
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