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Substance Name: Isoalloxazine, 9-(3-(4-methyl-1-piperazinyl)propyl)-, dihydrochloride
RN: 69382-23-6
InChIKey: MYLFRQZECQEXBQ-UHFFFAOYSA-N

Molecular Formula

  • C18-H22-N6-O2.2Cl-H

Molecular Weight

  • 427.334
 
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Names and Synonyms

Synonyms

  • (gamma-(Methyl-4 piperazino)propyl)-9 isoalloxazine dichlorhydrate
  • 9-(3-(4-Methyl-1-piperazinyl)propyl)isoalloxazine dihydrochloride

Systematic Name

  • Isoalloxazine, 9-(3-(4-methyl-1-piperazinyl)propyl)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 69382-23-6

System Generated Number

  • 0069382236

Molecular Formulas

Molecular Formula

  • C18-H22-N6-O2.2Cl-H

Molecular Formula Fragments

  • C18-H22-N6-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C18H22N6O2.2ClH/c1-23-8-10-24(11-9-23)7-3-5-12-4-2-6-13-14(12)20-16-15(19-13)17(25)22-18(26)21-16;;/h2,4,6H,3,5,7-11H2,1H3,(H2,20,21,22,25,26);2*1H

InChIKey

MYLFRQZECQEXBQ-UHFFFAOYSA-N

Smiles

Cl.Cl.c12c(nc3cccc(c3[nH]2)CCCN2CCN(C)CC2)c([nH]c(n1)=O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intravenous 160mg/kg (160mg/kg)   Chimica Therapeutica. Vol. 3, Pg. 100, 1968.