2,4,6(1H,3H,5H)-Pyrimidinetrione,5,5-diphenyl-

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Names

[ CAS No. ]:
21914-07-8

[ Name ]:
2,4,6(1H,3H,5H)-Pyrimidinetrione,5,5-diphenyl-

[Synonym ]:
5,5-diphenyl-pyrimidine-2,4,6-trione
5,5-Diphenylbarbituric acid
5,5-Diphenyl-barbitursaeure
Phenobarbital
Barbituric acid,5,5-diphenyl
Barbituric acid,5-diphenyl
5,5-Diphenyl-2,4,6(1H,3H,5H)-pyrimidinetrione

Chemical & Physical Properties

[ Density]:
1.304g/cm3

[ Molecular Formula ]:
C16H12N2O3

[ Molecular Weight ]:
280.27800

[ Exact Mass ]:
280.08500

[ PSA ]:
75.27000

[ LogP ]:
1.99630

[ Index of Refraction ]:
1.608

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CQ4196000
CHEMICAL NAME :
Barbituric acid, 5,5-diphenyl-
CAS REGISTRY NUMBER :
21914-07-8
LAST UPDATED :
199206
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C16-H12-N2-O3
MOLECULAR WEIGHT :
280.30
WISWESSER LINE NOTATION :
T6VMVMV FHJ FR& FR

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
572 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 89,356,1947

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Barbituric acid
  • Plumbane,tris(acetyloxy)phenyl-
  • 1,3-bis(methoxymethyl)-5,5-diphenyl-1,3-diazinane-2,4,6-trione
  • 2,4,6(1H,3H,5H)-Pyrimidinetrione,5,5-dihydroxy-
  • benzene
  • diphenyl-malonic acid diamide
  • 2,2-diphenylmalonyl dichloride
  • Sulfuric acid
  • Urea

DownStream

  • N-carbamoyl-2,2-diphenyl-acetamide

Related Compounds

  • 2,4,6(1H,3H,5H)-Pyrimidinetrione,5-[[5-(diethylamino)-2-furanyl]methylene]-1,3-diphenyl-
  • 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-[(5-methoxy-1H-indol-3-yl)methyl]-1,3-dimethyl
  • 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-[(5-methoxy-1H-indol-3-yl)methylene]-1,3-dimethyl
  • 2,4,6(1H,3H,5H)-Pyrimidinetrione,5,5-diethyl-1-(4-methylphenyl)-
  • 2,4,6(1H,3H,5H)-Pyrimidinetrione,5-[5-(hexahydro-2,4,6-trioxo-5-pyrimidinyl)-2,4-pentadien-1-ylidene]-
  • 2,4,6(1H,3H,5H)-Pyrimidinetrione,5-[[5-(diethylamino)-2-furanyl]methylene]-1-(2-fluorophenyl)-
  • 6-chloro-N-[3-[(5-methylthiazol-2-yl)amino]-3-oxo-propyl]-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carboxamide
  • 3-Methoxyphenyl 6-chloropyridine-3-sulfonate
  • 3-Cyclobutylprop-2-en-1-ol
  • 1,5-Bis(dimethylamino)pentan-3-ol
  • [1-(4-ethoxyphenyl)-1H-1,2,3-triazol-5-yl]acetic acid
  • 2-[2-(1H-indol-3-yl)ethyl]-N-(3-methoxypropyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxamide
  • 1-({2-[4-(Trifluoromethoxy)phenyl]-1,3-thiazol-4-yl}acetyl)-4-piperidinecarboxylic acid
  • Sodium 3-amino-4-methoxybenzenesulfonate
  • 2-methoxy-7-hydroxy-4H-chromen-4-one
  • 3-methyl-2-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-3H,4H,6H,7H-thieno[3,2-d]pyrimidin-4-one
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