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Substance Name: 3-(4-Aminophenethyl)-8-(3-noradamantyl)-1-propylxanthine
RN: 149741-42-4
InChIKey: WIQUEWXPOAOPDO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H31-N5-O2

Molecular Weight

  • 433.5529
 
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Names and Synonyms

Results Name

  • 3-(4-Aminophenethyl)-8-(3-noradamantyl)-1-propylxanthine

Synonym

  • 3-(4-Aminophenethyl)-8-(3-noradamantyl)-1-propylxanthine

Systematic Name

  • 1H-Purine-2,6-dione, 3,7-dihydro-3-(2-(4-aminophenyl)ethyl)-8-(hexahydro-2,5-methanopentalen-3a(1H)-yl)-1-propyl-

Registry Numbers

CAS Registry Number

  • 149741-42-4

System Generated Number

  • 0149741424

Structure Descriptors

InChI

1S/C25H31N5O2/c1-2-8-30-22(31)20-21(29(24(30)32)9-7-15-3-5-19(26)6-4-15)28-23(27-20)25-13-16-10-17(14-25)12-18(25)11-16/h3-6,16-18H,2,7-14,26H2,1H3,(H,27,28)

InChIKey

WIQUEWXPOAOPDO-UHFFFAOYSA-N

Smiles

CCCn1c(=O)c2c(nc([nH]2)C34CC5CC(C3)CC4C5)n(c1=O)CCc6ccc(cc6)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 300mg/kg (300mg/kg)   United States Patent Document. Vol. #5447933,