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848672-43-5

848672-43-5 structural image
Product Name: 11-butyl-3-sec-butyl-2-methyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Formula: C21H25N5O
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COMPUTED DESCRIPTORS

Molecular Weight 363.5 g/mol
XLogP3 3.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 5
Exact Mass 363.20591044 g/mol
Monoisotopic Mass 363.20591044 g/mol
Topological Polar Surface Area 63.4 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 593
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