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Substance Name: 1H-Benzimidazol-5-amine, 4,6-dinitro-2-methyl-N-(3-phenylpropyl)-
RN: 72766-30-4
InChIKey: QGDYREQCLZBPJP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H17-N5-O4

Molecular Weight

  • 355.352
 
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Names and Synonyms

Synonyms

  • 4,6-Dinitro-2-methyl-N-(3-phenylpropyl)-1H-benzimidazol-5-amine
  • BRN 0942250

Systematic Name

  • 1H-Benzimidazol-5-amine, 4,6-dinitro-2-methyl-N-(3-phenylpropyl)-

Registry Numbers

CAS Registry Number

  • 72766-30-4

System Generated Number

  • 0072766304

Structure Descriptors

InChI

1S/C17H17N5O4/c1-11-19-13-10-14(21(23)24)16(17(22(25)26)15(13)20-11)18-9-5-8-12-6-3-2-4-7-12/h2-4,6-7,10,18H,5,8-9H2,1H3,(H,19,20)

InChIKey

QGDYREQCLZBPJP-UHFFFAOYSA-N

Smiles

c1(c2c([nH]c(n2)C)cc(c1NCCCc1ccccc1)[N+]([O-])=O)[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.