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Substance Name: Piperazine, 1-(3-pyridinylcarbonyl)-4-(2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl)-
RN: 70454-31-8
InChIKey: NXQCELSBZYDWOQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H23-N7-O3

Molecular Weight

  • 397.4367
 
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Names and Synonyms

Synonyms

  • 5-26-14-00016 (Beilstein Handbook Reference)
  • BRN 1187437

Systematic Name

  • Piperazine, 1-(3-pyridinylcarbonyl)-4-(2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl)-

Registry Numbers

CAS Registry Number

  • 70454-31-8

System Generated Number

  • 0070454318

Structure Descriptors

InChI

1S/C19H23N7O3/c1-22-16-15(18(28)23(2)19(22)29)26(13-21-16)11-8-24-6-9-25(10-7-24)17(27)14-4-3-5-20-12-14/h3-5,12-13H,6-11H2,1-2H3

InChIKey

NXQCELSBZYDWOQ-UHFFFAOYSA-N

Smiles

CN1C(=O)N(C)c2ncn(CCN3CCN(CC3)C(=O)c4cccnc4)c2C1=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 600mg/kg (600mg/kg)   Farmaco, Edizione Scientifica. Vol. 34, Pg. 284, 1979.
mouse LD50 oral > 1gm/kg (1000mg/kg)   Farmaco, Edizione Scientifica. Vol. 34, Pg. 284, 1979.