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1374510-82-3

1374510-82-3 structural image
Product Name: Ethyl 7-[(1E)-2-ethoxyprop-1-en-1-yl][1,2,4]-triazolo[1,5-a]pyrimidine-6-carboxylate
Formula: C13H16N4O3
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COMPUTED DESCRIPTORS

Molecular Weight 276.29 g/mol
XLogP3 1.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 6
Exact Mass 276.12224039 g/mol
Monoisotopic Mass 276.12224039 g/mol
Topological Polar Surface Area 78.6 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 375
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes