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Substance Name: Piperazine, 1-benzyl-4-(2-(N-(alpha-(p-chlorophenyl)benzyl)-N-methylamino)ethyl)-, dimaleate
RN: 23905-12-6
InChIKey: IOJPULRGMBUOOO-SPIKMXEPSA-N

Molecular Formula

  • C27-H32-Cl-N3.2C4-H4-O4

Molecular Weight

  • 666.167
 
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Names and Synonyms

Synonym

  • 1-Benzyl-4-(2-(N-(alpha-(p-chlorophenyl)benzyl)-N-methylamino)ethyl)piperazine dimaleate

Systematic Name

  • Piperazine, 1-benzyl-4-(2-(N-(alpha-(p-chlorophenyl)benzyl)-N-methylamino)ethyl)-, dimaleate

Registry Numbers

CAS Registry Number

  • 23905-12-6

System Generated Number

  • 0023905126

Molecular Formulas

Molecular Formula

  • C27-H32-Cl-N3.2C4-H4-O4

Molecular Formula Fragments

  • C27-H32-Cl-N3
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C27H32ClN3.2C4H4O4/c1-29(27(24-10-6-3-7-11-24)25-12-14-26(28)15-13-25)16-17-30-18-20-31(21-19-30)22-23-8-4-2-5-9-23;2*5-3(6)1-2-4(7)8/h2-15,27H,16-22H2,1H3;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-

InChIKey

IOJPULRGMBUOOO-SPIKMXEPSA-N

Smiles

N1(Cc2ccccc2)CCN(CC1)CC[N@@](C)[C@@H](c1ccc(cc1)Cl)c1ccccc1.C(\C=C/C(=O)O)(=O)O.C(\C=C/C(=O)O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 400mg/kg (400mg/kg)   Journal of Medicinal Chemistry. Vol. 12, Pg. 860, 1969.