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478246-53-6

478246-53-6 structural image
Product Name: METHYL 4-[4-(3,4-DICHLOROPHENYL)PIPERAZINO]-3-NITROBENZENECARBOXYLATE
Formula: C18H17Cl2N3O4
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COMPUTED DESCRIPTORS

Molecular Weight 410.2 g/mol
XLogP3 4.6
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 4
Exact Mass 409.0596114 g/mol
Monoisotopic Mass 409.0596114 g/mol
Topological Polar Surface Area 78.6 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 539
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