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Substance Name: 1-Piperazinepropanamide, 4-((2-(phenylmethyl)phenyl)methyl)-, (Z)-2-butenedioate (1:1)
RN: 37652-68-9
InChIKey: WCWQOMVPVNQPHY-WLHGVMLRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H27-N3-O.C4-H4-O4

Molecular Weight

  • 453.5359
 
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Names and Synonyms

Synonym

  • 4-((2-(Phenylmethyl)phenyl)methyl)-1-piperazinepropanamide maleate

Systematic Name

  • 1-Piperazinepropanamide, 4-((2-(phenylmethyl)phenyl)methyl)-, (Z)-2-butenedioate (1:1)

Registry Numbers

CAS Registry Number

  • 37652-68-9

System Generated Number

  • 0037652689

Molecular Formulas

Molecular Formula

  • C21-H27-N3-O.C4-H4-O4

Molecular Formula Fragments

  • C21-H27-N3-O
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C21H27N3O.C4H4O4/c22-21(25)10-11-23-12-14-24(15-13-23)17-20-9-5-4-8-19(20)16-18-6-2-1-3-7-18;5-3(6)1-2-4(7)8/h1-9H,10-17H2,(H2,22,25);1-2H,(H,5,6)(H,7,8)/b;2-1+

InChIKey

WCWQOMVPVNQPHY-WLHGVMLRSA-N

Smiles

c1ccc(cc1)Cc2ccccc2CN3CCN(CC3)CCC(=O)N.C(=C/C(=O)O)\C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 87500ug/kg (87.5mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 37, Pg. 1371, 1972.