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Substance Name: 2-Pyrimidinamine, 5-bromo-4-chloro-N-heptyl-6-(4-methyl-1-piperazinyl)-, hydrochloride
RN: 61973-52-2
InChIKey: JWNUYZPPICHMQZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H27-Br-Cl-N5.Cl-H

Molecular Weight

  • 441.2422
 
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Names and Synonyms

Synonyms

  • 2-n-Heptylamino-4-(N-methylpiperazinyl)-5-bromo-6-chloropyrimidine hydrochloride
  • 5-Bromo-4-chloro-N-heptyl-6-(4-methyl-1-piperazinyl)-2-pyrimidinamine hydrochloride

Systematic Name

  • 2-Pyrimidinamine, 5-bromo-4-chloro-N-heptyl-6-(4-methyl-1-piperazinyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 61973-52-2

System Generated Number

  • 0061973522

Molecular Formulas

Molecular Formula

  • C16-H27-Br-Cl-N5.Cl-H

Molecular Formula Fragments

  • C16-H27-Br-Cl-N5
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C16H27BrClN5.ClH/c1-3-4-5-6-7-8-19-16-20-14(18)13(17)15(21-16)23-11-9-22(2)10-12-23;/h3-12H2,1-2H3,(H,19,20,21);1H

InChIKey

JWNUYZPPICHMQZ-UHFFFAOYSA-N

Smiles

CCCCCCCNc1nc(c(c(n1)Cl)Br)N2CCN(CC2)C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 900mg/kg (900mg/kg)   United States Patent Document. Vol. #4051244,