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Substance Name: Piperazine, 1-(3-(p-chlorophenyl)-3-phenylpropyl)-4-(m-tolyl)-, maleate
RN: 23941-12-0
InChIKey: BOUXOWUDFKARRK-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-(m-tolyl)piperazine maleate

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 23941-12-0

System Generated Number

  • 0023941120

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

InChIKey

BOUXOWUDFKARRK-BTJKTKAUSA-N

Smiles

N1(c2cc(C)ccc2)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.