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Substance Name: Acetophenone, 2-(4-(o-chlorophenyl)piperazinyl)-3',4',5'-trimethoxy-
RN: 17755-62-3
InChIKey: RQNRHFFZESIVSE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H25-Cl-N2-O4

Molecular Weight

  • 404.892
 
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Names and Synonyms

Synonyms

  • 1-(o-Chlorophenyl)-4-(3,4,5-trimethoxybenzoylmethyl)piperazine
  • 2-(4-(o-Chlorophenyl)piperazinyl)-3',4',5'-trimethoxyacetophenone
  • 5-23-02-00260 (Beilstein Handbook Reference)
  • BRN 1605299
  • Piperazine, 1-(o-chlorophenyl)-4-(3,4,5-trimethoxybenzoylmethyl)-

Systematic Name

  • Acetophenone, 2-(4-(o-chlorophenyl)piperazinyl)-3',4',5'-trimethoxy-

Registry Numbers

CAS Registry Number

  • 17755-62-3

System Generated Number

  • 0017755623

Structure Descriptors

InChI

1S/C21H25ClN2O4/c1-26-19-12-15(13-20(27-2)21(19)28-3)18(25)14-23-8-10-24(11-9-23)17-7-5-4-6-16(17)22/h4-7,12-13H,8-11,14H2,1-3H3

InChIKey

RQNRHFFZESIVSE-UHFFFAOYSA-N

Smiles

c1(c(cc(C(CN2CCN(c3c(cccc3)Cl)CC2)=O)cc1OC)OC)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 415mg/kg (415mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) Journal of Medicinal Chemistry. Vol. 11, Pg. 332, 1968.