Free Chemical Databases
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[Synonyms]
NSC355930
79462-73-0
[Structure]
[ Properties Computed from Structure]
Molecular Weight 297.93204 [g/mol] Molecular Formula C6H6Br2N2O2 XLogP 0.9 H-Bond Donor 0 H-Bond Acceptor 2 Rotatable Bond Count 0 Exact Mass 297.877556 MonoIsotopic Mass 295.879603 Topological Polar Surface Area 40.6 Heavy Atom Count 12 Formal Charge 0 Complexity 287 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
[ Descriptors Computed from Structure]
IUPAC Name: 5,6-dibromo-1,3-dimethylpyrimidine-2,4-dione
Canonical SMILES: CN1C(=C(C(=O)N(C1=O)C)Br)Br
InChI: InChI=1/C6H6Br2N2O2/c1-9-4(8)3(7)5(11)10(2)6(9)12/h1-2H3
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