Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Pyrimidine, 6-(allyloxy)-2-(methylamino)-4-(4-methyl-1-piperazinyl)-5-(methylthio)-, monohydrochloride
RN: 55477-42-4
InChIKey: ACECGTLKKXDOIW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H23-N5-O-S.Cl-H

Molecular Weight

  • 345.8966
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • 6-(Allyloxy)-2-(methylamino)-4-(4-methyl-1-piperazinyl)-5-(methylthio)pyrimidine hydrochloride

Systematic Name

  • Pyrimidine, 6-(allyloxy)-2-(methylamino)-4-(4-methyl-1-piperazinyl)-5-(methylthio)-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 55477-42-4

System Generated Number

  • 0055477424

Molecular Formulas

Molecular Formula

  • C14-H23-N5-O-S.Cl-H

Molecular Formula Fragments

  • C14-H23-N5-O-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C14H23N5OS.ClH/c1-5-10-20-13-11(21-4)12(16-14(15-2)17-13)19-8-6-18(3)7-9-19;/h5H,1,6-10H2,2-4H3,(H,15,16,17);1H

InChIKey

ACECGTLKKXDOIW-UHFFFAOYSA-N

Smiles

CNc1nc(c(c(n1)OCC=C)SC)N2CCN(CC2)C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 56mg/kg (56mg/kg)   Journal of Medicinal Chemistry. Vol. 18, Pg. 553, 1975.
mouse LD50 oral 400mg/kg (400mg/kg)   Journal of Medicinal Chemistry. Vol. 18, Pg. 553, 1975.