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585557-30-8

585557-30-8 structural image
Product Name: (5E)-5-[1-(1,3-benzodioxol-5-ylmethylamino)ethylidene]-1-phenyl-1,3-diazinane-2,4,6-trione
Formula: C20H17N3O5
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility 6.6 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 379.4 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 4
Exact Mass 379.11682065 g/mol
Monoisotopic Mass 379.11682065 g/mol
Topological Polar Surface Area 101 Ų
Heavy Atom Count 28
Formal Charge 0
Complexity 698
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