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Substance Name: 1-Piperazineethanamine, 4-((4-chlorophenyl)-4-pyridinylmethyl)-N-(2,6-dimethyl-3-nitro-4-pyridinyl)-, tetrahydrochloride
RN: 110629-38-4
InChIKey: WOGFFDHDPKHEQI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H29-Cl-N6-O2.4Cl-H

Molecular Weight

  • 626.8407
 
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Names and Synonyms

  • 1-Piperazineethanamine, 4-((4-chlorophenyl)-4-pyridinylmethyl)-N-(2,6-dimethyl-3-nitro-4-pyridinyl)-, tetrahydrochloride

Registry Numbers

CAS Registry Number

  • 110629-38-4

System Generated Number

  • 0110629384

Molecular Formulas

Molecular Formula

  • C25-H29-Cl-N6-O2.4Cl-H

Molecular Formula Fragments

  • C25-H29-Cl-N6-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C25H29ClN6O2.4ClH/c1-18-17-23(24(32(33)34)19(2)29-18)28-11-12-30-13-15-31(16-14-30)25(21-7-9-27-10-8-21)20-3-5-22(26)6-4-20;;;;/h3-10,17,25H,11-16H2,1-2H3,(H,28,29);4*1H

InChIKey

WOGFFDHDPKHEQI-UHFFFAOYSA-N

Smiles

Cc1cc(c(c(n1)C)[N+](=O)[O-])NCCN2CCN(CC2)C(c3ccc(cc3)Cl)c4ccncc4.Cl.Cl.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 300mg/kg (300mg/kg)   United States Patent Document. Vol. #4792554,