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339015-97-3

339015-97-3 structural image
Product Name: 5-[2-(2,4-DIFLUOROPHENYL)DIAZENYL]-2-(METHYLSULFANYL)-4,6-PYRIMIDINEDIOL
Formula: C11H8F2N4O2S
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility 34.8 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 298.27 g/mol
XLogP3 2.3
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 3
Exact Mass 298.03360301 g/mol
Monoisotopic Mass 298.03360301 g/mol
Topological Polar Surface Area 112 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 495
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