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500196-86-1

500196-86-1 structural image
Product Name: N,N-dibutyl-2-((5-propyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl)thio)acetamide
Formula: C26H36N4OS2
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COMPUTED DESCRIPTORS

Molecular Weight 484.7 g/mol
XLogP3 7.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 11
Exact Mass 484.23305413 g/mol
Monoisotopic Mass 484.23305413 g/mol
Topological Polar Surface Area 113 Ų
Heavy Atom Count 33
Formal Charge 0
Complexity 615
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