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Substance Name: 1-Piperazineacetic acid, 4-(3-chlorophenyl)-alpha-(2-(4-chlorophenyl)-2-oxoethyl)-
RN: 139084-71-2
InChIKey: RIQZZIITKFLZNA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H20-Cl2-N2-O3

Molecular Weight

  • 407.295
 
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Names and Synonyms

Synonym

  • 4-(3-Chlorophenyl)-alpha-(2-(4-chlorophenyl)-2-oxoethyl)-1-piperazineacetic acid

Systematic Name

  • 1-Piperazineacetic acid, 4-(3-chlorophenyl)-alpha-(2-(4-chlorophenyl)-2-oxoethyl)-

Registry Numbers

CAS Registry Number

  • 139084-71-2

System Generated Number

  • 0139084712

Structure Descriptors

InChI

1S/C20H20Cl2N2O3/c21-15-6-4-14(5-7-15)19(25)13-18(20(26)27)24-10-8-23(9-11-24)17-3-1-2-16(22)12-17/h1-7,12,18H,8-11,13H2,(H,26,27)

InChIKey

RIQZZIITKFLZNA-UHFFFAOYSA-N

Smiles

c1cc(cc(c1)Cl)N2CCN(CC2)C(CC(=O)c3ccc(cc3)Cl)C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1833mg/kg (1833mg/kg)   Polish Journal of Pharmacology and Pharmacy. Vol. 43, Pg. 271, 1991.
mouse LD50 oral 2500mg/kg (2500mg/kg)   Polish Journal of Pharmacology and Pharmacy. Vol. 43, Pg. 271, 1991.