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848669-85-2

848669-85-2 structural image
Product Name: (E)-3-(2-(cyclohex-1-en-1-yl)ethyl)-2-methyl-11-((thiophen-2-ylmethylene)amino)-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4(11H)-one
Formula: C26H24N6OS
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COMPUTED DESCRIPTORS

Molecular Weight 468.6 g/mol
XLogP3 4.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 5
Exact Mass 468.17323058 g/mol
Monoisotopic Mass 468.17323058 g/mol
Topological Polar Surface Area 104 Ų
Heavy Atom Count 34
Formal Charge 0
Complexity 873
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes