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Substance Name: 2,6-Piperazinedione, 1-(2-pyridylmethyl)-4-(p-(2-pyrimidinylamino)benzyl)-
RN: 102233-14-7
InChIKey: INHMRSKZMDRVQU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H20-N6-O2

Molecular Weight

  • 388.429
 
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Names and Synonyms

Synonym

  • 1-(2-Pyridylmethyl)-4-(p-(2-pyrimidinylamino)benzyl)-2,6-piperazinedione

Systematic Name

  • 2,6-Piperazinedione, 1-(2-pyridylmethyl)-4-(p-(2-pyrimidinylamino)benzyl)-

Registry Numbers

CAS Registry Number

  • 102233-14-7

System Generated Number

  • 0102233147

Structure Descriptors

InChI

1S/C21H20N6O2/c28-19-14-26(15-20(29)27(19)13-18-4-1-2-9-22-18)12-16-5-7-17(8-6-16)25-21-23-10-3-11-24-21/h1-11H,12-15H2,(H,23,24,25)

InChIKey

INHMRSKZMDRVQU-UHFFFAOYSA-N

Smiles

N1(C(CN(CC1=O)Cc1ccc(cc1)Nc1ncccn1)=O)Cc1ccccn1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 200mg/kg (200mg/kg)   Chemical and Pharmaceutical Bulletin. Vol. 29, Pg. 1253, 1981.