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Substance Name: m-Dioxane-5-methanol, 2-(3,4-dimethoxyphenyl)-5-(4,6-diaziridinyl-2-s-triazinylamino)-
RN: 73987-08-3
InChIKey: POBJFOWZTSZNQJ-UHFFFAOYSA-N

Molecular Formula

  • C20-H26-N6-O5

Molecular Weight

  • 430.462
 
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Names and Synonyms

Synonym

  • 2-(3,4-Dimethoxyphenyl)-5-(4,6-diaziridinyl-2-s-triazinylamino)-m-dioxane-5-methanol

Systematic Name

  • m-Dioxane-5-methanol, 2-(3,4-dimethoxyphenyl)-5-(4,6-diaziridinyl-2-s-triazinylamino)-

Registry Numbers

CAS Registry Number

  • 73987-08-3

System Generated Number

  • 0073987083

Structure Descriptors

InChI

1S/C20H26N6O5/c1-28-14-4-3-13(9-15(14)29-2)16-30-11-20(10-27,12-31-16)24-17-21-18(25-5-6-25)23-19(22-17)26-7-8-26/h3-4,9,16,27H,5-8,10-12H2,1-2H3,(H,21,22,23,24)

InChIKey

POBJFOWZTSZNQJ-UHFFFAOYSA-N

Smiles

C1(Nc2nc(N3CC3)nc(n2)N2CC2)(COC(c2cc(c(OC)cc2)OC)OC1)CO

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1628ug/kg (1.628mg/kg)   Khimiko-Farmatsevticheskii Zhurnal. Chemical Pharmaceutical Journal. For English translation, see PCJOAU. Vol. 12(4), Pg. 67, 1978.