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Substance Name: 2,3-Piperazinedione, 1-(3-phenylpropyl)-4-((4-(2-pyrimidinylamino)phenyl)methyl)-
RN: 77917-33-0
InChIKey: XFLZSQJMNAIZIS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H25-N5-O2

Molecular Weight

  • 415.4945
 
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Names and Synonyms

Synonyms

  • 1-(3-Phenylpropyl)-4-((4-(2-pyrimidinylamino)phenyl)methyl)-2,3-piperazinedione
  • BRN 5654222

Systematic Name

  • 2,3-Piperazinedione, 1-(3-phenylpropyl)-4-((4-(2-pyrimidinylamino)phenyl)methyl)-

Registry Numbers

CAS Registry Number

  • 77917-33-0

System Generated Number

  • 0077917330

Structure Descriptors

InChI

1S/C24H25N5O2/c30-22-23(31)29(17-16-28(22)15-4-8-19-6-2-1-3-7-19)18-20-9-11-21(12-10-20)27-24-25-13-5-14-26-24/h1-3,5-7,9-14H,4,8,15-18H2,(H,25,26,27)

InChIKey

XFLZSQJMNAIZIS-UHFFFAOYSA-N

Smiles

c1ccc(cc1)CCCN2CCN(C(=O)C2=O)Cc3ccc(cc3)Nc4ncccn4

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 500mg/kg (500mg/kg)   Chemical and Pharmaceutical Bulletin. Vol. 29, Pg. 1253, 1981.