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413620-34-5

413620-34-5 structural image
Product Name: ETHANONE, 1-[4-[[6-(3,5-DIMETHYL-1H-PYRAZOL-1-YL)-4-PYRIMIDINYL]OXY]PHENYL]-
Formula: C17H16N4O2
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COMPUTED DESCRIPTORS

Molecular Weight 308.33 g/mol
XLogP3 2.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 4
Exact Mass 308.12732577 g/mol
Monoisotopic Mass 308.12732577 g/mol
Topological Polar Surface Area 69.9 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 411
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