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Substance Name: 1-Piperazinepropanamine, N-(2,6-dimethyl-3-nitro-4-pyridinyl)-4-(diphenylmethyl)-, trihydrochloride
RN: 110629-29-3
InChIKey: MTHKJWDSLLZTPQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C27-H33-N5-O2.3Cl-H

Molecular Weight

  • 568.9734
 
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Names and Synonyms

  • 1-Piperazinepropanamine, N-(2,6-dimethyl-3-nitro-4-pyridinyl)-4-(diphenylmethyl)-, trihydrochloride

Registry Numbers

CAS Registry Number

  • 110629-29-3

System Generated Number

  • 0110629293

Molecular Formulas

Molecular Formula

  • C27-H33-N5-O2.3Cl-H

Molecular Formula Fragments

  • C27-H33-N5-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C27H33N5O2.3ClH/c1-21-20-25(26(32(33)34)22(2)29-21)28-14-9-15-30-16-18-31(19-17-30)27(23-10-5-3-6-11-23)24-12-7-4-8-13-24;;;/h3-8,10-13,20,27H,9,14-19H2,1-2H3,(H,28,29);3*1H

InChIKey

MTHKJWDSLLZTPQ-UHFFFAOYSA-N

Smiles

Cc1cc(c(c(n1)C)[N+](=O)[O-])NCCCN2CCN(CC2)C(c3ccccc3)c4ccccc4.Cl.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 150mg/kg (150mg/kg)   United States Patent Document. Vol. #4792554,