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Substance Name: 1H-Purine, 6,6'-(1,4,10,13-tetraoxa-7,16-diazacyclooctadecane-7,16-diyl)bis-
RN: 149246-42-4
InChIKey: ZEALNJMXZDNVRJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H30-N10-O4

Molecular Weight

  • 498.545
 
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Names and Synonyms

Synonyms

  • 1,4,10,13-Tetraoxa-7,16-diazacyclooctadecane, 7,16-di(1H-pyrin-6-yl)-
  • 6,6'-(1,4,10,13-Tetraoxa-7,16-diazacyclooctadecane-7,16-diyl)bis-1H-purine

Systematic Name

  • 1H-Purine, 6,6'-(1,4,10,13-tetraoxa-7,16-diazacyclooctadecane-7,16-diyl)bis-

Registry Numbers

CAS Registry Number

  • 149246-42-4

System Generated Number

  • 0149246424

Structure Descriptors

InChI

1S/C22H30N10O4/c1-5-33-9-10-35-7-3-32(22-18-20(26-14-24-18)28-16-30-22)4-8-36-12-11-34-6-2-31(1)21-17-19(25-13-23-17)27-15-29-21/h13-16H,1-12H2,(H,23,25,27,29)(H,24,26,28,30)

InChIKey

ZEALNJMXZDNVRJ-UHFFFAOYSA-N

Smiles

c1[nH]c(c-2ncnc2n1)N3CCOCCOCCN(CCOCCOCC3)c4c-5ncnc5nc[nH]4

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 335260ug/kg (335.26mg/kg)   Pharmaceutical Chemistry Journal Vol. 26, Pg. 745, 1993.