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Substance Name: 1H-Purine-2,6-dione, 3,7-dihydro-3-methyl-8-(4-morpholinyl)-7-(2-phenoxyethyl)-
RN: 105522-55-2
InChIKey: ODVAGHYWBQCJFU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H21-N5-O4

Molecular Weight

  • 371.3949
 
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Names and Synonyms

Synonyms

  • 3,7-Dihydro-3-methyl-8-(4-morpholinyl)-7-(2-phenoxyethyl)-1H-purine-2,6-dione
  • 7-(2-Phenoxyethyl)-8-morpholino-3-methylxanthine

Systematic Name

  • 1H-Purine-2,6-dione, 3,7-dihydro-3-methyl-8-(4-morpholinyl)-7-(2-phenoxyethyl)-

Registry Numbers

CAS Registry Number

  • 105522-55-2

System Generated Number

  • 0105522552

Structure Descriptors

InChI

1S/C18H21N5O4/c1-21-15-14(16(24)20-18(21)25)23(9-12-27-13-5-3-2-4-6-13)17(19-15)22-7-10-26-11-8-22/h2-6H,7-12H2,1H3,(H,20,24,25)

InChIKey

ODVAGHYWBQCJFU-UHFFFAOYSA-N

Smiles

Cn1c2c(c(=O)[nH]c1=O)n(c(n2)N3CCOCC3)CCOc4ccccc4

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 672mg/kg (672mg/kg)   Pharmaceutical Chemistry Journal Vol. 20, Pg. 37, 1986.