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Substance Name: Piperazine, 1-(p-tert-butylbenzyl)-4-(2-(alpha-(p-chlorophenyl)benzylamino)ethyl)-, dimaleate
RN: 22662-91-5
InChIKey: PGXOVOMUCBJSPE-SPIKMXEPSA-N

Molecular Formula

  • C30-H38-Cl-N3.2C4-H4-O4

Molecular Weight

  • 708.247
 
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Names and Synonyms

Synonym

  • 1-(p-tert-Butylbenzyl)-4-(2-(alpha-(p-chlorophenyl)benzylamino)ethyl)piperazine dimaleate

Systematic Name

  • Piperazine, 1-(p-tert-butylbenzyl)-4-(2-(alpha-(p-chlorophenyl)benzylamino)ethyl)-, dimaleate

Registry Numbers

CAS Registry Number

  • 22662-91-5

System Generated Number

  • 0022662915

Molecular Formulas

Molecular Formula

  • C30-H38-Cl-N3.2C4-H4-O4

Molecular Formula Fragments

  • C30-H38-Cl-N3
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C30H38ClN3.2C4H4O4/c1-30(2,3)27-13-9-24(10-14-27)23-34-21-19-33(20-22-34)18-17-32-29(25-7-5-4-6-8-25)26-11-15-28(31)16-12-26;2*5-3(6)1-2-4(7)8/h4-16,29,32H,17-23H2,1-3H3;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-

InChIKey

PGXOVOMUCBJSPE-SPIKMXEPSA-N

Smiles

N1(Cc2ccc(C(C)(C)C)cc2)CCN(CCN[C@@H](c2ccc(cc2)Cl)c2ccccc2)CC1.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 162mg/kg (162mg/kg)   Journal of Medicinal Chemistry. Vol. 12, Pg. 860, 1969.