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2098122-67-7

2098122-67-7 structural image
Product Name: 4(1H)-Pyrimidinone, 2,3-dihydro-6-(5-methyl-2-pyrazinyl)-2-thioxo-
Formula: C9H8N4OS
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COMPUTED DESCRIPTORS

Molecular Weight 220.25 g/mol
XLogP3 -0.4
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 1
Exact Mass 220.04188206 g/mol
Monoisotopic Mass 220.04188206 g/mol
Topological Polar Surface Area 99 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 328
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