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956746-49-9

956746-49-9 structural image
Product Name: N-(4-ethoxyphenyl)-5-oxo-6,7-dihydro-1H-[1,2,4]triazolo[4,3-a]pyrimidine-7-carboxamide
Formula: C14H15N5O3
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COMPUTED DESCRIPTORS

Molecular Weight 301.30 g/mol
XLogP3 0.6
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 4
Exact Mass 301.11748936 g/mol
Monoisotopic Mass 301.11748936 g/mol
Topological Polar Surface Area 98.1 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 425
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 1
Compound Is Canonicalized Yes