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300393-05-9

300393-05-9 structural image
Product Name: 4,5,7-trimethyl-1,2,4a,7a-tetrahydroimidazo[4,5-e][1,2,4]triazine-3,6-dione
Formula: C7H13N5O2
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COMPUTED DESCRIPTORS

Molecular Weight 199.21 g/mol
XLogP3 -1.3
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 0
Exact Mass 199.10692467 g/mol
Monoisotopic Mass 199.10692467 g/mol
Topological Polar Surface Area 67.9 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 294
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes