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551921-02-9

551921-02-9 structural image
Product Name: 4-(2-Chloro-pyridine-3-carbonyl)-piperazine-1-carboxylic acid tert-butyl ester
Formula: C15H20ClN3O3
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility >48.9 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 325.79 g/mol
XLogP3 1.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 325.1193192 g/mol
Monoisotopic Mass 325.1193192 g/mol
Topological Polar Surface Area 62.7 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 417
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