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Substance Name: m-Dioxane-5-axial-methanol, 5-equatorial-((4,6-bis(1-aziridinyl)-s-triazin-2-yl)amino)-2-equatorial-(3,4-dimethoxyphenyl)-
RN: 67026-20-4
InChIKey: POBJFOWZTSZNQJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H26-N6-O5

Molecular Weight

  • 430.462
 
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Names and Synonyms

  • m-Dioxane-5-axial-methanol, 5-equatorial-((4,6-bis(1-aziridinyl)-s-triazin-2-yl)amino)-2-equatorial-(3,4-dimethoxyphenyl)-

Registry Numbers

CAS Registry Number

  • 67026-20-4

System Generated Number

  • 0067026204

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 10805ug/kg (10.805mg/kg)   Pharmaceutical Chemistry Journal Vol. 12, Pg. 481, 1978.