141266-46-8
Product Name:
5-[(6-BROMO-1,3-BENZODIOXOL-5-YL)METHYLENE]-2,4,6(1H,3H,5H)-PYRIMIDINETRIONE
Formula:
C12H7BrN2O5
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COMPUTED DESCRIPTORS
Molecular Weight | 339.10 g/mol |
---|---|
XLogP3 | 1.5 |
Hydrogen Bond Donor Count | 2 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 1 |
Exact Mass | 337.95383 g/mol |
Monoisotopic Mass | 337.95383 g/mol |
Topological Polar Surface Area | 93.7 Ų |
Heavy Atom Count | 20 |
Formal Charge | 0 |
Complexity | 484 |
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 |