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Substance Name: 1-Piperazinepropionic acid, 4-(2-((o-methoxyphenyl)phenylmethoxy)ethyl)-, dimaleate
RN: 61897-09-4
InChIKey: MOUCGOKKPAIIHE-LVEZLNDCSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H30-N2-O4.2C4-H4-O4

Molecular Weight

  • 630.6432
 
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Names and Synonyms

Synonyms

  • 1-(2-((2-Methoxybenzhydryl)oxy)ethyl)-4-(2-carboxyethyl)piperazine dimaleate
  • 1-Piperazinepropanoic acid, 4-(2-((2-methoxyphenyl)phenylmethoxy)ethyl)-, (Z)-2-butenedioate

Systematic Name

  • 1-Piperazinepropionic acid, 4-(2-((o-methoxyphenyl)phenylmethoxy)ethyl)-, dimaleate

Registry Numbers

CAS Registry Number

  • 61897-09-4

System Generated Number

  • 0061897094

Molecular Formulas

Molecular Formula

  • C23-H30-N2-O4.2C4-H4-O4

Molecular Formula Fragments

  • C23-H30-N2-O4
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C23H30N2O4.2C4H4O4/c1-28-21-10-6-5-9-20(21)23(19-7-3-2-4-8-19)29-18-17-25-15-13-24(14-16-25)12-11-22(26)27;2*5-3(6)1-2-4(7)8/h2-10,23H,11-18H2,1H3,(H,26,27);2*1-2H,(H,5,6)(H,7,8)/b;2*2-1+

InChIKey

MOUCGOKKPAIIHE-LVEZLNDCSA-N

Smiles

COc1c(cccc1)C(OCCN2CCN(CC2)CCC(=O)O)c3ccccc3.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 1387mg/kg (1387mg/kg)   Journal of Medicinal Chemistry. Vol. 23, Pg. 149, 1980.