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Substance Name: Pyrimidine, 4,6-bis((1-methyl-4-piperidinyl)oxy)-5-(methylthio)-2-(1-piperidinyl)-, dihydrobromide
RN: 57259-16-2
InChIKey: VAEWFIJMIDXLEQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H37-N5-O2-S.2Br-H.H2-O

Molecular Weight

  • 597.4571
 
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Names and Synonyms

Synonym

  • 2-Piperidin-4,6-di-((4')-N-methylpiperidyl)-oxy-5-methylthiopyrimidin dihydrobromid hydrate

Systematic Name

  • Pyrimidine, 4,6-bis((1-methyl-4-piperidinyl)oxy)-5-(methylthio)-2-(1-piperidinyl)-, dihydrobromide

Registry Numbers

CAS Registry Number

  • 57259-16-2

System Generated Number

  • 0057259162

Molecular Formulas

Molecular Formula

  • C22-H37-N5-O2-S.2Br-H.H2-O

Molecular Formula Fragments

  • Br-H
  • C22-H37-N5-O2-S
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C22H37N5O2S.2BrH/c1-25-13-7-17(8-14-25)28-20-19(30-3)21(29-18-9-15-26(2)16-10-18)24-22(23-20)27-11-5-4-6-12-27;;/h17-18H,4-16H2,1-3H3;2*1H

InChIKey

VAEWFIJMIDXLEQ-UHFFFAOYSA-N

Smiles

CN1CCC(CC1)Oc2c(c(nc(n2)N3CCCCC3)OC4CCN(CC4)C)SC.Br.Br

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 79mg/kg (79mg/kg)   German Offenlegungsschrift Patent Document. Vol. #2503136,
mouse LD50 oral 800mg/kg (800mg/kg)   German Offenlegungsschrift Patent Document. Vol. #2503136,