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Substance Name: 1,3-Propanediol, 2-((4,6-bis(1-aziridinyl)-s-triazin-2-ylamino))-2-(hydroxymethyl)-
RN: 65792-54-3
InChIKey: NEFYOYZVLOKGOD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H18-N6-O3

Molecular Weight

  • 282.3022
 
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Names and Synonyms

Synonyms

  • 1,3-Propanediol, 2-(4,6-diaziridinyl-2-s-triazinylamino)-2-hydroxymethyl-
  • 2-(4,6-Bis(1-aziridinyl)-s-triazin-2-ylamino)-2-hydroxymethyl-1,3-propanediol
  • 2-(4,6-Diaziridinyl-2-s-triazinylamino)-2-hydroxymethyl-1,3-propanediol
  • 6-(Tris(hydroxymethyl)methylamino)-2,4-di(ethyleneimino)triazine
  • BRN 0561316

Systematic Name

  • 1,3-Propanediol, 2-((4,6-bis(1-aziridinyl)-s-triazin-2-ylamino))-2-(hydroxymethyl)-

Registry Numbers

CAS Registry Number

  • 65792-54-3

System Generated Number

  • 0065792543

Structure Descriptors

InChI

1S/C11H18N6O3/c18-5-11(6-19,7-20)15-8-12-9(16-1-2-16)14-10(13-8)17-3-4-17/h18-20H,1-7H2,(H,12,13,14,15)

InChIKey

NEFYOYZVLOKGOD-UHFFFAOYSA-N

Smiles

C1CN1c2nc(nc(n2)N3CC3)NC(CO)(CO)CO

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 4997ug/kg (4.997mg/kg)   Pharmaceutical Chemistry Journal Vol. 12, Pg. 481, 1978.
rat LD50 intraperitoneal 3800ug/kg (3.8mg/kg)   Voprosy Onkologii. Problems of Oncology. For English translation, see PONCAU. Vol. 23(12), Pg. 70, 1977.