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Substance Name: 1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-7-(2-((2-(4-hydroxyphenyl)-1-methyl-2-oxoethyl)amino)ethyl)-, monohydrochloride, (+-)-
RN: 62932-62-1
InChIKey: FBBGZDPPXSZGTF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H21-N5-O4.Cl-H

Molecular Weight

  • 407.8558
 
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Names and Synonyms

Synonym

  • D 476 (+-)

Systematic Name

  • 1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-7-(2-((2-(4-hydroxyphenyl)-1-methyl-2-oxoethyl)amino)ethyl)-, monohydrochloride, (+-)-

Registry Numbers

CAS Registry Number

  • 62932-62-1

System Generated Number

  • 0062932621

Molecular Formulas

Molecular Formula

  • C18-H21-N5-O4.Cl-H

Molecular Formula Fragments

  • C18-H21-N5-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C18H21N5O4.ClH/c1-11(15(25)12-4-6-13(24)7-5-12)19-8-9-23-10-20-16-14(23)17(26)22(3)18(27)21(16)2;/h4-7,10-11,19,24H,8-9H2,1-3H3;1H

InChIKey

FBBGZDPPXSZGTF-UHFFFAOYSA-N

Smiles

Cl.CC(NCCn1cnc2N(C)C(=O)N(C)C(=O)c12)C(=O)c3ccc(O)cc3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 790mg/kg (790mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 27, Pg. 14, 1977.