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Substance Name: 1H-Benzimidazole, 4,6-dinitro-2-methyl-5-(4-phenyl-1-piperazinyl)-
RN: 72766-24-6
InChIKey: NLRFOKSZBNXTLK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H18-N6-O4

Molecular Weight

  • 382.378
 
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Names and Synonyms

Synonyms

  • 4,6-Dinitro-2-methyl-5-(4-phenyl-1-piperazinyl)-1H-benzimidazole
  • BRN 0945732

Systematic Name

  • 1H-Benzimidazole, 4,6-dinitro-2-methyl-5-(4-phenyl-1-piperazinyl)-

Registry Numbers

CAS Registry Number

  • 72766-24-6

System Generated Number

  • 0072766246

Structure Descriptors

InChI

1S/C18H18N6O4/c1-12-19-14-11-15(23(25)26)17(18(24(27)28)16(14)20-12)22-9-7-21(8-10-22)13-5-3-2-4-6-13/h2-6,11H,7-10H2,1H3,(H,19,20)

InChIKey

NLRFOKSZBNXTLK-UHFFFAOYSA-N

Smiles

c1(c(c([N+]([O-])=O)cc2c1nc(C)[nH]2)N1CCN(CC1)c1ccccc1)[N+]([O-])=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 unreported > 1gm/kg (1000mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 17, Pg. 164, 1979.