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75989-96-7

75989-96-7 structural image
Product Name: ETHYL 4-(BENZOYLAMINO)-2-CYANO-3-HYDROXY-5-PHENYL-2,4-PENTADIENOATE
Formula: C21H18N2O4
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COMPUTED DESCRIPTORS

Molecular Weight 362.4 g/mol
XLogP3 3.8
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 7
Exact Mass 362.12665706 g/mol
Monoisotopic Mass 362.12665706 g/mol
Topological Polar Surface Area 99.4 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 644
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 2
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes