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Substance Name: 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1,3-bis((dodecyloxy)methyl)-5-(1-oxopropoxy)-5-(1-phenylethyl)-
RN: 56353-72-1
InChIKey: BTZUDGDNGAJRGS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C41-H68-N2-O7

Molecular Weight

  • 700.9952
 
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Names and Synonyms

Synonyms

  • 1,3-Bis((dodecyloxy)methyl)-5-(1-oxopropoxy)-5-(1-phenylethyl)barbituric acid
  • BRN 0737933

Systematic Name

  • 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1,3-bis((dodecyloxy)methyl)-5-(1-oxopropoxy)-5-(1-phenylethyl)-

Registry Numbers

CAS Registry Number

  • 56353-72-1

System Generated Number

  • 0056353721

Structure Descriptors

InChI

1S/C41H68N2O7/c1-5-8-10-12-14-16-18-20-22-27-31-48-33-42-38(45)41(50-37(44)7-3,35(4)36-29-25-24-26-30-36)39(46)43(40(42)47)34-49-32-28-23-21-19-17-15-13-11-9-6-2/h24-26,29-30,35H,5-23,27-28,31-34H2,1-4H3

InChIKey

BTZUDGDNGAJRGS-UHFFFAOYSA-N

Smiles

CCCCCCCCCCCCOCN1C(=O)C(C(=O)N(C1=O)COCCCCCCCCCCCC)(C(C)c2ccccc2)OC(=O)CC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg) LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Journal of Medicinal Chemistry. Vol. 18, Pg. 694, 1975.