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21323-87-5

21323-87-5 structural image
Product Name: N-(1,6-DIHYDRO-6-OXOPURIN-2-YL)-BENZAMIDE
Formula: C12H9N5O2
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COMPUTED DESCRIPTORS

Molecular Weight 255.23 g/mol
XLogP3 0.8
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 255.07562455 g/mol
Monoisotopic Mass 255.07562455 g/mol
Topological Polar Surface Area 99.2 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 416
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

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