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Substance Name: 1,4-Piperidinediamine, N(sup 4),N(sup 4)-dimethyl-N(sup 1)-((1-methyl-2-nitro-1H-imidazol-5-yl)methylene)-
RN: 57831-86-4
InChIKey: XYXNTVOEEWYIIF-NTEUORMPSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H20-N6-O2

Molecular Weight

  • 280.33
 
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Names and Synonyms

Synonym

  • BRN 0682630

Systematic Name

  • 1,4-Piperidinediamine, N(sup 4),N(sup 4)-dimethyl-N(sup 1)-((1-methyl-2-nitro-1H-imidazol-5-yl)methylene)-

Registry Numbers

CAS Registry Number

  • 57831-86-4

System Generated Number

  • 0057831864

Structure Descriptors

InChI

1S/C12H20N6O2/c1-15(2)10-4-6-17(7-5-10)14-9-11-8-13-12(16(11)3)18(19)20/h8-10H,4-7H2,1-3H3/b14-9+

InChIKey

XYXNTVOEEWYIIF-NTEUORMPSA-N

Smiles

CN(C)C1CCN(CC1)\N=C\c2cnc([N+](=O)[O-])n2C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 27, Pg. 1391, 1977.