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478246-41-2

478246-41-2 structural image
Product Name: METHYL 4-[4-(4-METHOXYBENZOYL)PIPERAZINO]-3-NITROBENZENECARBOXYLATE
Formula: C20H21N3O6
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COMPUTED DESCRIPTORS

Molecular Weight 399.4 g/mol
XLogP3 2.6
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 5
Exact Mass 399.14303540 g/mol
Monoisotopic Mass 399.14303540 g/mol
Topological Polar Surface Area 105 Ų
Heavy Atom Count 29
Formal Charge 0
Complexity 594
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