thialbarbital

Suppliers

Names

[ CAS No. ]:
467-36-7

[ Name ]:
thialbarbital

[Synonym ]:
Tialbarbitale [DCIT]
5-allyl-5-cyclohex-2-enyl-2-thioxo-dihydro-pyrimidine-4,6-dione
Thialpenton
5-Allyl-5-cyclohex-2-enyl-2-thio-barbitursaeure
Thialbarbitalum [INN-Latin]
Thialbarbital
Tialbarbital [INN-Spanish]
Thialbarbitone
4,6(1H,5H)-Pyrimidinedione,5-(2-cyclohexen-1-yl)dihydro-5-(2-propenyl)-2-thioxo
Thialbital,5-Allyl-5-<cyclohexen-(2)-yl>-2-thio-barbitursaeure
Kemithal
Thiohexallymalum
5-allyl-5-cyclohex-2-enyl-2-thio-barbituric acid
EINECS 207-390-3

Chemical & Physical Properties

[ Density]:
1.25g/cm3

[ Molecular Formula ]:
C13H16N2O2S

[ Molecular Weight ]:
264.34300

[ Exact Mass ]:
264.09300

[ PSA ]:
97.27000

[ LogP ]:
1.98790

[ Index of Refraction ]:
1.606

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CP8400000
CHEMICAL NAME :
Barbituric acid, 5-allyl-5-(2-cyclohexen-1-yl)-2-thio-
CAS REGISTRY NUMBER :
467-36-7
LAST UPDATED :
199007
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C13-H16-N2-O2-S
MOLECULAR WEIGHT :
264.37
WISWESSER LINE NOTATION :
T6VMYMV FHJ CUS F2U1 F- CL6UTJ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
175 mg/kg
TOXIC EFFECTS :
Behavioral - altered sleep time (including change in righting reflex)
REFERENCE :
AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium) V.4- 1898- Volume(issue)/page/year: 106,437,1956
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
370 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
BJPCAL British Journal of Pharmacology and Chemotherapy. (London, UK) V.1-33, 1946-68. For publisher information, see BJPCBM. Volume(issue)/page/year: 1,215,1946
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
384 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
BJPCAL British Journal of Pharmacology and Chemotherapy. (London, UK) V.1-33, 1946-68. For publisher information, see BJPCBM. Volume(issue)/page/year: 1,215,1946
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
240 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FSTEAI Farmaco. Scienza e Tecnica. (Pavia, Italy) V.1-7, 1946-52. For publisher information, see FRPSAX. Volume(issue)/page/year: 3,269,1948
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
390 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
BJPCAL British Journal of Pharmacology and Chemotherapy. (London, UK) V.1-33, 1946-68. For publisher information, see BJPCBM. Volume(issue)/page/year: 1,215,1946

Synthetic Route


Related Compounds

  • Thialbarbital
  • Thialbarbital sodium
  • 1-methanesulfonyl-N-{4H,6H-thieno[3,4-c][1,2]oxazol-3-yl}azetidine-3-carboxamide
  • 1-N-hydroxy4-ethoxy-2-hydroxybenzene-1-carboximidic acid
  • tert-Butyl (2-(trifluoromethyl)thiazol-5-yl)carbamate
  • 4-bromo-7-chloro-1H-pyrrolo[2,3-c]pyridine-3-carbaldehyde
  • 7-bromo-1-(phenylsulfonyl)-1H-pyrrolo[3,2-c]pyridine
  • Methyl cis-3-acetylcyclopentane-1-carboxylate
  • 2-(4-chlorophenyl)-N-(2-(1,5-dimethyl-1H-pyrazol-3-yl)ethyl)acetamide
  • N-(2-(1,5-dimethyl-1H-pyrazol-3-yl)ethyl)-5-phenylisoxazole-3-carboxamide
  • N-(2-(1,5-dimethyl-1H-pyrazol-3-yl)ethyl)nicotinamide
  • 2-((difluoromethyl)sulfonyl)-N-(2-(1,5-dimethyl-1H-pyrazol-3-yl)ethyl)benzamide
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