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Substance Name: 1H-Purine-2,6-dione, 3,7-dihydro-8-(2-(4-(bis(4-fluorophenyl)methyl)-1-piperazinyl)ethyl)-1-methyl-3-(2-methylpropyl)-
RN: 90749-42-1
InChIKey: MTVINMRLHMQUTA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C29-H34-F2-N6-O2

Molecular Weight

  • 536.6236
 
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Names and Synonyms

Synonym

  • BRN 5685966

Systematic Name

  • 1H-Purine-2,6-dione, 3,7-dihydro-8-(2-(4-(bis(4-fluorophenyl)methyl)-1-piperazinyl)ethyl)-1-methyl-3-(2-methylpropyl)-

Registry Numbers

CAS Registry Number

  • 90749-42-1

System Generated Number

  • 0090749421

Structure Descriptors

InChI

1S/C29H34F2N6O2/c1-19(2)18-37-27-25(28(38)34(3)29(37)39)32-24(33-27)12-13-35-14-16-36(17-15-35)26(20-4-8-22(30)9-5-20)21-6-10-23(31)11-7-21/h4-11,19,26H,12-18H2,1-3H3,(H,32,33)

InChIKey

MTVINMRLHMQUTA-UHFFFAOYSA-N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1600mg/kg (1600mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 22, Pg. 243, 1987.