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799832-36-3

799832-36-3 structural image
Product Name: 2-methyl-3-(4-methylbenzyl)-11-octyl-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4(11H)-one
Formula: C29H33N5O
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COMPUTED DESCRIPTORS

Molecular Weight 467.6 g/mol
XLogP3 6.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 9
Exact Mass 467.26851069 g/mol
Monoisotopic Mass 467.26851069 g/mol
Topological Polar Surface Area 63.4 Ų
Heavy Atom Count 35
Formal Charge 0
Complexity 747
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes