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941245-72-3

941245-72-3 structural image
Product Name: 7-(2-methoxyethyl)-2-(methylsulfanyl)pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
Formula: C12H13N5O2S
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COMPUTED DESCRIPTORS

Molecular Weight 291.33 g/mol
XLogP3 0.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 4
Exact Mass 291.07899585 g/mol
Monoisotopic Mass 291.07899585 g/mol
Topological Polar Surface Area 97.9 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 407
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