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341967-74-6

341967-74-6 structural image
Product Name: METHYL 4-(4-[2-(4-METHYLPHENYL)-2-OXOETHYL]PIPERAZINO)-3-NITROBENZENECARBOXYLATE
Formula: C21H23N3O5
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COMPUTED DESCRIPTORS

Molecular Weight 397.4 g/mol
XLogP3 3.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 6
Exact Mass 397.16377084 g/mol
Monoisotopic Mass 397.16377084 g/mol
Topological Polar Surface Area 95.7 Ų
Heavy Atom Count 29
Formal Charge 0
Complexity 592
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