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439094-88-9

439094-88-9 structural image
Product Name: 4-BROMO-N-(2-[4-(4-BROMOBENZOYL)PIPERAZINO]ETHYL)BENZENECARBOXAMIDE
Formula: C20H21Br2N3O2
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COMPUTED DESCRIPTORS

Molecular Weight 495.2 g/mol
XLogP3 3.5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 5
Exact Mass 494.99800 g/mol
Monoisotopic Mass 493.00005 g/mol
Topological Polar Surface Area 52.6 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 496
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