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1002404-80-9

1002404-80-9 structural image
Product Name: Imidazo[1,5-a]pyrazin-3(2H)-one, hexahydro-2-[3-(methylthio)phenyl]-, hydrochloride (1:1)
Formula: C13H17N3OS
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COMPUTED DESCRIPTORS

Molecular Weight 299.82 g/mol
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 299.0859111 g/mol
Monoisotopic Mass 299.0859111 g/mol
Topological Polar Surface Area 60.9 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 325
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes