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Substance Name: Barbituric acid, 5-acetonyl-5-allyl-1-cyclohexyl-
RN: 53632-50-1
InChIKey: ZJSORIKEFVSKCL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H22-N2-O4

Molecular Weight

  • 306.3598
 
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Names and Synonyms

Synonyms

  • 5-24-09-00419 (Beilstein Handbook Reference)
  • 5-Acetonyl-5-allyl-1-cyclohexylbarbituric acid
  • 5-Allyl-1-cyclohexyl-5-acetonylbarbituric acid
  • BRN 0695170

Systematic Name

  • Barbituric acid, 5-acetonyl-5-allyl-1-cyclohexyl-

Registry Numbers

CAS Registry Number

  • 53632-50-1

System Generated Number

  • 0053632501

Structure Descriptors

InChI

1S/C16H22N2O4/c1-3-9-16(10-11(2)19)13(20)17-15(22)18(14(16)21)12-7-5-4-6-8-12/h3,12H,1,4-10H2,2H3,(H,17,20,22)

InChIKey

ZJSORIKEFVSKCL-UHFFFAOYSA-N

Smiles

CC(=O)CC1(CC=C)C(=O)NC(=O)N(C2CCCCC2)C1=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 139mg/kg (139mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) Archivum Immunologiae et Therapiae Experimentalis. Vol. 22, Pg. 261, 1974.