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64268-92-4

64268-92-4 structural image
Product Name: ethyl 4-((4-nitrophenyl)sulfonyl)piperazine-1-carboxylate
Formula: C13H17N3O6S
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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 343.36 g/mol
XLogP3 0.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 4
Exact Mass 343.08380644 g/mol
Monoisotopic Mass 343.08380644 g/mol
Topological Polar Surface Area 121 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 525
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