4(3H)-Pyrimidinone, 3-(2-methoxyphenyl)-2-(methylthio)-

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Names

[ CAS No. ]:
80306-56-5

[ Name ]:
4(3H)-Pyrimidinone, 3-(2-methoxyphenyl)-2-(methylthio)-

[Synonym ]:
3-(2-methoxyphenyl)-2-methylthio-4(3H)-pyrimidinone
4(3H)-Pyrimidinone,3-(2-methoxyphenyl)-2-(methylthio)

Chemical & Physical Properties

[ Density]:
1.23g/cm3

[ Boiling Point ]:
390.9ºC at 760 mmHg

[ Molecular Formula ]:
C12H12N2O2S

[ Molecular Weight ]:
248.30100

[ Flash Point ]:
190.2ºC

[ Exact Mass ]:
248.06200

[ PSA ]:
69.42000

[ LogP ]:
1.96300

[ Index of Refraction ]:
1.607

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UW7526740
CHEMICAL NAME :
4(3H)-Pyrimidinone, 3-(2-methoxyphenyl)-2-(methylthio)-
CAS REGISTRY NUMBER :
80306-56-5
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H12-N2-O2-S
MOLECULAR WEIGHT :
248.32

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 :
600 mg/kg
TOXIC EFFECTS :
Behavioral - somnolence (general depressed activity)
REFERENCE :
IJSBDB Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. (Publications & Information Directorate, Council of Scientific and Industrial Research (CSIR), Hillside Rd., New Delhi 110 012, India) V.14B- 1976- Volume(issue)/page/year: 22,789,1983

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • N-(2-methoxyphenyl)-S-methylisothiourea
  • Ethyl propiolate

DownStream

Related Compounds

  • rel-(I+/-S)-4-Methoxy-I+/--[(1R)-1-(methylamino)ethyl]benzenemethanol
  • 2-methyl-N-((tetrahydrofuran-2-yl)methyl)-5-(3-(thiophen-3-yl)-1,2,4-oxadiazol-5-yl)pyrimidin-4-amine
  • N-(2,2-dimethoxyethyl)-2-methyl-5-(3-(thiophen-3-yl)-1,2,4-oxadiazol-5-yl)pyrimidin-4-amine
  • 4-(2-((2-Methyl-5-(3-(thiophen-3-yl)-1,2,4-oxadiazol-5-yl)pyrimidin-4-yl)amino)ethyl)benzenesulfonamide
  • Ethyl 4-((2-methyl-5-(3-(thiophen-3-yl)-1,2,4-oxadiazol-5-yl)pyrimidin-4-yl)amino)piperidine-1-carboxylate
  • 4-((2-Methyl-5-(3-(thiophen-3-yl)-1,2,4-oxadiazol-5-yl)pyrimidin-4-yl)amino)benzenesulfonamide
  • 5-(4-(4-(2-Ethoxyphenyl)piperazin-1-yl)-2-methylpyrimidin-5-yl)-3-(thiophen-3-yl)-1,2,4-oxadiazole
  • N-(2,3-dihydro-1H-inden-1-yl)-2-methyl-5-(3-(thiophen-3-yl)-1,2,4-oxadiazol-5-yl)pyrimidin-4-amine
  • 3-((5-(3-(2-Fluorophenyl)-1,2,4-oxadiazol-5-yl)pyrimidin-4-yl)amino)benzonitrile
  • 5-(3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl)-N-(pyridin-2-ylmethyl)pyrimidin-4-amine
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