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Substance Name: Piperazine, 1-(3-(p-chlorophenyl)-3-phenylpropyl)-4-(o-methoxyphenyl)-, maleate
RN: 63978-31-4
InChIKey: TVKSVWZWMMEYAH-BTJKTKAUSA-N

Molecular Formula

  • C26-H29-Cl-N2-O.C4-H4-O4

Molecular Weight

  • 537.053
 
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Names and Synonyms

Synonym

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

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 63978-31-4

System Generated Number

  • 0063978314

Molecular Formulas

Molecular Formula

  • C26-H29-Cl-N2-O.C4-H4-O4

Molecular Formula Fragments

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

Structure Descriptors

InChI

1S/C26H29ClN2O.C4H4O4/c1-30-25-9-5-8-24(20-25)29-18-16-28(17-19-29)15-14-26(21-6-3-2-4-7-21)22-10-12-23(27)13-11-22;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

TVKSVWZWMMEYAH-BTJKTKAUSA-N

Smiles

N1(c2cc(ccc2)OC)CCN(CC1)CC[C@@H](c1ccc(cc1)Cl)c1ccccc1.C(=C/C(O)=O)\C(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.