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Substance Name: Piperazine, 1-(1-(4-methoxyphenyl)-3-phenylpropyl)-4-methyl-, (Z)-2-butenedioate (1:2)
RN: 40028-11-3
InChIKey: CPDVFUYILKQWEB-LVEZLNDCSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H28-N2-O.2C4-H4-O4

Molecular Weight

  • 556.6084
 
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Names and Synonyms

Synonym

  • 1-(1-(4-Methoxyphenyl)-3-phenylpropyl)-4-methylpiperazine dimaleate

Systematic Name

  • Piperazine, 1-(1-(4-methoxyphenyl)-3-phenylpropyl)-4-methyl-, (Z)-2-butenedioate (1:2)

Registry Numbers

CAS Registry Number

  • 40028-11-3

System Generated Number

  • 0040028113

Molecular Formulas

Molecular Formula

  • C21-H28-N2-O.2C4-H4-O4

Molecular Formula Fragments

  • C21-H28-N2-O
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C21H28N2O.2C4H4O4/c1-22-14-16-23(17-15-22)21(13-8-18-6-4-3-5-7-18)19-9-11-20(24-2)12-10-19;2*5-3(6)1-2-4(7)8/h3-7,9-12,21H,8,13-17H2,1-2H3;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1+

InChIKey

CPDVFUYILKQWEB-LVEZLNDCSA-N

Smiles

CN1CCN(CC1)C(c2ccc(cc2)OC)CCc3ccccc3.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 750mg/kg (750mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 37, Pg. 3124, 1972.