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Substance Name: Piperazine, 1-(3-(p-chlorophenyl)-3-phenylpropyl)-4-(p-tolyl)-, maleate
RN: 23904-73-6
InChIKey: NVVRBHIOPUCQQU-BTJKTKAUSA-N

Molecular Formula

  • C26-H29-Cl-N2.C4-H4-O4

Molecular Weight

  • 521.054
 
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Names and Synonyms

Synonym

  • 1-(3-(p-Chlorophenyl)-3-phenylpropyl)-4-(p-tolyl)piperazine maleate

Systematic Name

  • Piperazine, 1-(3-(p-chlorophenyl)-3-phenylpropyl)-4-(p-tolyl)-, maleate

Registry Numbers

CAS Registry Number

  • 23904-73-6

System Generated Number

  • 0023904736

Molecular Formulas

Molecular Formula

  • C26-H29-Cl-N2.C4-H4-O4

Molecular Formula Fragments

  • C26-H29-Cl-N2
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C26H29ClN2.C4H4O4/c1-21-7-13-25(14-8-21)29-19-17-28(18-20-29)16-15-26(22-5-3-2-4-6-22)23-9-11-24(27)12-10-23;5-3(6)1-2-4(7)8/h2-14,26H,15-20H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-

InChIKey

NVVRBHIOPUCQQU-BTJKTKAUSA-N

Smiles

N1(c2ccc(C)cc2)CCN(CC1)CC[C@@H](c1ccc(cc1)Cl)c1ccccc1.C(\C=C/C(=O)O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 800mg/kg (800mg/kg)   Journal of Medicinal Chemistry. Vol. 12, Pg. 860, 1969.