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311326-51-9

311326-51-9 structural image
Product Name: 2-Amino-5-oxo-7-phenyl-4-(2-thienyl)-4,6,7,8-TETRAHYDRO2H-chromene-3-carbonitrile
Formula: C20H16N2O2S
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COMPUTED DESCRIPTORS

Molecular Weight 348.4 g/mol
XLogP3 3.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 2
Exact Mass 348.09324893 g/mol
Monoisotopic Mass 348.09324893 g/mol
Topological Polar Surface Area 104 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 681
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes