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Substance Name: 6H-Pyrrolo(2,3-d)pyrimidin-6-one, 5,7-dihydro-2-(3,4-dihydro-2(1H)-isoquinolinyl)-7-methyl-, monohydrochloride
RN: 122113-25-1
InChIKey: DFUPNMZUMXDJGN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H16-N4-O.Cl-H

Molecular Weight

  • 316.7903
 
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Names and Synonyms

  • 6H-Pyrrolo(2,3-d)pyrimidin-6-one, 5,7-dihydro-2-(3,4-dihydro-2(1H)-isoquinolinyl)-7-methyl-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 122113-25-1

System Generated Number

  • 0122113251

Molecular Formulas

Molecular Formula

  • C16-H16-N4-O.Cl-H

Molecular Formula Fragments

  • C16-H16-N4-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C16H16N4O.ClH/c1-19-14(21)8-13-9-17-16(18-15(13)19)20-7-6-11-4-2-3-5-12(11)10-20;/h2-5,9H,6-8,10H2,1H3;1H

InChIKey

DFUPNMZUMXDJGN-UHFFFAOYSA-N

Smiles

CN1c2c(cnc(n2)N3CCc4ccccc4C3)CC1=O.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 500mg/kg (500mg/kg)   United States Patent Document. Vol. #5304555,