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439120-63-5

439120-63-5 structural image
Product Name: 6-(2-[3-(2,5-DIMETHYL-1H-PYRROL-1-YL)-2-THIENYL]PYRAZOLO[1,5-A]PYRIMIDIN-7-YL)-5H-[1,3]THIAZOLO[3,2-A]PYRIMIDIN-5-ONE
Formula: C22H16N6OS2
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COMPUTED DESCRIPTORS

Molecular Weight 444.5 g/mol
XLogP3 2.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 3
Exact Mass 444.08270150 g/mol
Monoisotopic Mass 444.08270150 g/mol
Topological Polar Surface Area 121 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 836
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