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899946-14-6

899946-14-6 structural image
Product Name: Benzamide, N-(1,4-dihydro-4-oxo-1-phenyl-5H-pyrazolo[3,4-d]pyrimidin-5-yl)-4-nitro-
Formula: C18H12N6O4
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COMPUTED DESCRIPTORS

Molecular Weight 376.3 g/mol
XLogP3 2.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 2
Exact Mass 376.09200289 g/mol
Monoisotopic Mass 376.09200289 g/mol
Topological Polar Surface Area 125 Ų
Heavy Atom Count 28
Formal Charge 0
Complexity 651
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