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194282-74-1

194282-74-1 structural image
Product Name: 4H,5H-PYRANO[4,3-B]PYRAN-3-CARBONITRILE, 2-AMINO-7-METHYL-4-(4-METHYLPHENYL)-5-OXO-
Formula: C17H14N2O3
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COMPUTED DESCRIPTORS

Molecular Weight 294.30 g/mol
XLogP3 2.6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 1
Exact Mass 294.10044231 g/mol
Monoisotopic Mass 294.10044231 g/mol
Topological Polar Surface Area 85.3 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 655
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