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Substance Name: 6H-Pyrrolo(2,3-d)pyrimidin-6-one, 5,7-dihydro-2-(4-(1,1-dimethylethyl)-1-piperidinyl)-7-methyl-, monohydrochloride
RN: 122113-19-3
InChIKey: XSNBKKFEHBGTHJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H24-N4-O.Cl-H

Molecular Weight

  • 324.8535
 
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Names and Synonyms

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

Registry Numbers

CAS Registry Number

  • 122113-19-3

System Generated Number

  • 0122113193

Molecular Formulas

Molecular Formula

  • C16-H24-N4-O.Cl-H

Molecular Formula Fragments

  • C16-H24-N4-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C16H24N4O.ClH/c1-16(2,3)12-5-7-20(8-6-12)15-17-10-11-9-13(21)19(4)14(11)18-15;/h10,12H,5-9H2,1-4H3;1H

InChIKey

XSNBKKFEHBGTHJ-UHFFFAOYSA-N

Smiles

CC(C)(C)C1CCN(CC1)c2ncc3c(n2)N(C(=O)C3)C.Cl

Toxicity

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