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Substance Name: 7H-Purine-7-ethanimidamide, 1,2,3,6-tetrahydro-N-(2-(3,4-dimethoxyphenyl)ethyl)-1,3-dimethyl-2,6-dioxo-, monohydrochloride
RN: 126480-54-4
InChIKey: JAELEEZRHKXCSN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H24-N6-O4.Cl-H

Molecular Weight

  • 436.8975
 
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Names and Synonyms

  • 7H-Purine-7-ethanimidamide, 1,2,3,6-tetrahydro-N-(2-(3,4-dimethoxyphenyl)ethyl)-1,3-dimethyl-2,6-dioxo-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 126480-54-4

System Generated Number

  • 0126480544

Molecular Formulas

Molecular Formula

  • C19-H24-N6-O4.Cl-H

Molecular Formula Fragments

  • C19-H24-N6-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C19H24N6O4.ClH/c1-23-17-16(18(26)24(2)19(23)27)25(11-22-17)10-15(20)21-8-7-12-5-6-13(28-3)14(9-12)29-4;/h5-6,9,11H,7-8,10H2,1-4H3,(H2,20,21);1H

InChIKey

JAELEEZRHKXCSN-UHFFFAOYSA-N

Smiles

Cn1c2c(c(=O)n(c1=O)C)n(cn2)C/C(=N/CCc3ccc(c(c3)OC)OC)/N.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 71mg/kg (71mg/kg)   Pharmaceutical Chemistry Journal Vol. 23, Pg. 849, 1989.