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Substance Name: 1-Piperazineacetamide, N-methyl-4-((1-(3-oxo-3-phenylpropyl)-1H-benzimidazol-2-yl)methyl)-, (Z)-2-butenedioate (1:2)
RN: 60959-84-4
InChIKey: GODJHQJATCFOIN-LVEZLNDCSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H29-N5-O2.2C4-H4-O4

Molecular Weight

  • 651.6693
 
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Names and Synonyms

  • 1-Piperazineacetamide, N-methyl-4-((1-(3-oxo-3-phenylpropyl)-1H-benzimidazol-2-yl)methyl)-, (Z)-2-butenedioate (1:2)

Registry Numbers

CAS Registry Number

  • 60959-84-4

System Generated Number

  • 0060959844

Molecular Formulas

Molecular Formula

  • C24-H29-N5-O2.2C4-H4-O4

Molecular Formula Fragments

  • C24-H29-N5-O2
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C24H29N5O2.2C4H4O4/c1-25-24(31)18-28-15-13-27(14-16-28)17-23-26-20-9-5-6-10-21(20)29(23)12-11-22(30)19-7-3-2-4-8-19;2*5-3(6)1-2-4(7)8/h2-10H,11-18H2,1H3,(H,25,31);2*1-2H,(H,5,6)(H,7,8)/b;2*2-1+

InChIKey

GODJHQJATCFOIN-LVEZLNDCSA-N

Smiles

CNC(=O)CN1CCN(CC1)Cc2n(c3c(n2)cccc3)CCC(=O)c4ccccc4.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 180mg/kg (180mg/kg)   United States Patent Document. Vol. #4072682,