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Substance Name: 2-Pyrimidinamine, 4-chloro-N-cyclohexyl-6-(4-methyl-1-piperzinyl)-5-(methylthio)-
RN: 59717-60-1
InChIKey: RQIGAIGBKIMQBU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H26-Cl-N5-S

Molecular Weight

  • 355.9354
 
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Names and Synonyms

Synonyms

  • 2-Cyclohexylamino-4-N-methylpiperazino-6-chloro-5-methylthiopyrimidine
  • 4-Chloro-N-cyclohexyl-6-(4-methyl-1-piperzinyl)-5-(methylthio)-2-pyrimidinamine

Systematic Name

  • 2-Pyrimidinamine, 4-chloro-N-cyclohexyl-6-(4-methyl-1-piperzinyl)-5-(methylthio)-

Registry Numbers

CAS Registry Number

  • 59717-60-1

System Generated Number

  • 0059717601

Structure Descriptors

InChI

1S/C16H26ClN5S/c1-21-8-10-22(11-9-21)15-13(23-2)14(17)19-16(20-15)18-12-6-4-3-5-7-12/h12H,3-11H2,1-2H3,(H,18,19,20)

InChIKey

RQIGAIGBKIMQBU-UHFFFAOYSA-N

Smiles

CN1CCN(CC1)c2c(c(nc(n2)NC3CCCCC3)Cl)SC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 89mg/kg (89mg/kg)   United States Patent Document. Vol. #4166852,
mouse LD50 oral > 900mg/kg (900mg/kg)   United States Patent Document. Vol. #4166852,