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304868-54-0

304868-54-0 structural image
Product Name: ethyl 6-amino-5-cyano-2-(2-ethoxy-2-oxoethyl)-4-(4-methylphenyl)-4H-pyran-3-carboxylate
Formula: C20H22N2O5
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COMPUTED DESCRIPTORS

Molecular Weight 370.4 g/mol
XLogP3 2.6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 8
Exact Mass 370.15287181 g/mol
Monoisotopic Mass 370.15287181 g/mol
Topological Polar Surface Area 112 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 692
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