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865659-12-7

865659-12-7 structural image
Product Name: ETHYL 1-(3-CYANO-4,6-DIMETHYL-2-PYRIDINYL)-4-PIPERIDINECARBOXYLATE
Formula: C16H21N3O2
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility 36.9 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 287.36 g/mol
XLogP3 2.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 4
Exact Mass 287.16337692 g/mol
Monoisotopic Mass 287.16337692 g/mol
Topological Polar Surface Area 66.2 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 409
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