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477865-83-1

477865-83-1 structural image
Product Name: ETHYL 5-CYANO-2-PHENYL-6-(PROPYLAMINO)NICOTINATE
Formula: C18H19N3O2
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COMPUTED DESCRIPTORS

Molecular Weight 309.4 g/mol
XLogP3 4.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 7
Exact Mass 309.147726857 g/mol
Monoisotopic Mass 309.147726857 g/mol
Topological Polar Surface Area 75 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 425
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes