339015-97-3
Product Name:
5-[2-(2,4-DIFLUOROPHENYL)DIAZENYL]-2-(METHYLSULFANYL)-4,6-PYRIMIDINEDIOL
Formula:
C11H8F2N4O2S
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Solubility | 34.8 [ug/mL] (The mean of the results at pH 7.4) |
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COMPUTED DESCRIPTORS
Molecular Weight | 298.27 g/mol |
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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 |