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848746-72-5

848746-72-5 structural image
Product Name: 11-(4-ethoxyphenyl)-3-isopentyl-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4(11H)-one
Formula: C25H25N5O2
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COMPUTED DESCRIPTORS

Molecular Weight 427.5 g/mol
XLogP3 4.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 6
Exact Mass 427.20082506 g/mol
Monoisotopic Mass 427.20082506 g/mol
Topological Polar Surface Area 72.6 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 692
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