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Substance Name: 1,3-Propanediol, 2-((4,6-bis(1-aziridinyl)-s-triazin-2-yl)amino)-2-methyl-
RN: 60819-42-3
InChIKey: YKVCDJBETRCQFL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H18-N6-O2

Molecular Weight

  • 266.303
 
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Names and Synonyms

Synonyms

  • 1,3-Propanediol, 2-(4,6-diaziridinyl-2-s-triazinylamino)-2-methyl-
  • 2-((4,6-Bis(1-aziridinyl)-1,3,5-triazin-2-yl)amino)-2-methyl-1,3-propanediol
  • 2-((4,6-Bis(1-aziridinyl)-s-triazin-2-yl)amino)-2-methyl-1,3-propanediol
  • 2-(4,6-Diaziridinyl-2-s-triazinylamino)-2-methyl-1,3-propanediol
  • 6-(1-(1,2-Dihydroxymethyl)ethylamino)-2,4-di(ethyleneimino)triazine
  • BRN 0554214
  • s-Triazine, 2,4-diaziridinyl-6-(1,3-dihydroxy-2-methyl-2-propylamino)-

Systematic Name

  • 1,3-Propanediol, 2-((4,6-bis(1-aziridinyl)-s-triazin-2-yl)amino)-2-methyl-

Registry Numbers

CAS Registry Number

  • 60819-42-3

System Generated Number

  • 0060819423

Structure Descriptors

InChI

1S/C11H18N6O2/c1-11(6-18,7-19)15-8-12-9(16-2-3-16)14-10(13-8)17-4-5-17/h18-19H,2-7H2,1H3,(H,12,13,14,15)

InChIKey

YKVCDJBETRCQFL-UHFFFAOYSA-N

Smiles

n1c(N2CC2)nc(N2CC2)nc1NC(C)(CO)CO

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 13mg/kg (13mg/kg)   Pharmaceutical Chemistry Journal Vol. 12, Pg. 481, 1978.
rat LD50 intraperitoneal 8mg/kg (8mg/kg)   Voprosy Onkologii. Problems of Oncology. For English translation, see PONCAU. Vol. 23(12), Pg. 70, 1977.