5-propan-2-yl-5-[(E)-prop-1-enyl]-1,3-diazinane-2,4,6-trione

Names

[ Name ]:
5-propan-2-yl-5-[(E)-prop-1-enyl]-1,3-diazinane-2,4,6-trione

[Synonym ]:
BARBITURIC ACID,5-ISOPROPYL-5-(1-PROPENYL)
5-isopropyl-5-propenyl-barbituric acid
5-Isopropyl-5-(1-propenyl)barbituric acid
5-Isopropyl-5-propenyl-barbitursaeure
2,6(1H,3H,5H)-Pyrimidinetrione,5-(1-methylethyl)-5-(1-propenyl)

Chemical & Physical Properties

[ Density]:
1.205g/cm3

[ Molecular Formula ]:
C₁₀H₁₄N₂O₃

[ Molecular Weight ]:
210.23000

[ Exact Mass ]:
210.10000

[ PSA ]:
75.27000

[ LogP ]:
1.22850

[ Index of Refraction ]:
1.543

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: CQ7160400

CHEMICAL NAME :: Barbituric acid, 5-isopropyl-5-(1-propenyl)-

CAS REGISTRY NUMBER :: 67051-43-8

BEILSTEIN REFERENCE NO. :: 0209403

LAST UPDATED :: 199612

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C10-H14-N2-O3

MOLECULAR WEIGHT :: 210.26

WISWESSER LINE NOTATION :: T6VMVMV FHJ FY1&1 F1U2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 520 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: JACSAT Journal of the American Chemical Society. (American Chemical Soc., Distribution Office Dept. 223, POB 57136, West End Stn., Washington, DC 20037) V.1- 1879- Volume(issue)/page/year: 62,1199,1940

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 425 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: JACSAT Journal of the American Chemical Society. (American Chemical Soc., Distribution Office Dept. 223, POB 57136, West End Stn., Washington, DC 20037) V.1- 1879- Volume(issue)/page/year: 62,1199,1940

Related Compounds

2-((1-(2-amino-2-oxoethyl)-5-(hydroxymethyl)-1H-imidazol-2-yl)thio)-N-(2,5-dimethylphenyl)acetamide
2-{[1-({[(4-chlorophenyl)methyl]carbamoyl}methyl)-5-(hydroxymethyl)-1H-imidazol-2-yl]sulfanyl}-N-(2,5-dimethylphenyl)acetamide
N-(2,5-dimethylphenyl)-2-{[7-(4-methoxyphenyl)-5H,6H,7H-imidazo[2,1-c][1,2,4]triazol-3-yl]sulfanyl}acetamide
N-(4-(2-((2,5-dimethylphenyl)amino)-2-oxoethyl)thiazol-2-yl)-4-methoxybenzamide
N-(2,5-dimethylphenyl)-2-(3-(3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl)-4,6-dimethyl-2-oxopyridin-1(2H)-yl)acetamide
2-(3-(3-(benzo[d][1,3]dioxol-5-yl)-1,2,4-oxadiazol-5-yl)-4,6-dimethyl-2-oxopyridin-1(2H)-yl)-N-(2,5-dimethylphenyl)acetamide
2-{3-[(2H-1,3-benzodioxol-5-yl)methyl]-2,4-dioxo-1H,2H,3H,4H-pyrido[3,2-d]pyrimidin-1-yl}-N-(2,5-dimethylphenyl)acetamide
N-(2,5-dimethylphenyl)-2-(2-((4-(furan-2-carbonyl)piperazin-1-yl)methyl)-5-methoxy-4-oxopyridin-1(4H)-yl)acetamide
N-(2,5-dimethylphenyl)-2-(2-((4-(4-fluorophenyl)piperazin-1-yl)methyl)-5-methoxy-4-oxopyridin-1(4H)-yl)acetamide
N-(2,5-dimethylphenyl)-2-(5-methoxy-4-oxo-2-((4-phenylpiperazin-1-yl)methyl)pyridin-1(4H)-yl)acetamide

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