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

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Names

[ CAS No. ]:
89069-18-1

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

Chemical & Physical Properties

[ Density]:
1.21g/cm3

[ Boiling Point ]:
351.3ºC at 760 mmHg

[ Molecular Formula ]:
C11H10N2OS

[ Molecular Weight ]:
218.27500

[ Flash Point ]:
166.2ºC

[ Exact Mass ]:
218.05100

[ PSA ]:
60.19000

[ LogP ]:
1.95440

[ Index of Refraction ]:
1.628

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UW7537800
CHEMICAL NAME :
4(3H)-Pyrimidinone, 2-(methylthio)-3-phenyl-
CAS REGISTRY NUMBER :
89069-18-1
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C11-H10-N2-O-S
MOLECULAR WEIGHT :
218.29

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 :
400 mg/kg
TOXIC EFFECTS :
Kidney, Ureter, Bladder - urine volume increased Biochemical - Metabolism (Intermediary) - effect on inflammation or mediation of inflammation
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

  • 1-phenyl-2-methyl-2-thiopseudourea
  • Ethyl propiolate
  • ketene
  • 1-phenyl-4-dimethylamino-2-thiomethyl-1,3-diazabutadiene

DownStream

Related Compounds

  • 4(3H)-Pyrimidinone, 2-(methylthio)-3-(3-(trifluoromethyl)phenyl)-
  • 3-benzyl-2-methylsulfanylpyrimidin-4-one
  • 4(3H)-Pyrimidinone,2-(methylthio)-6-phenyl-
  • 4(3H)-Pyrimidinone,2-amino-6-methyl-5-[(3-phenyl-2-propen-1-yl)amino]-
  • 4(3H)-Pyrimidinone,2-(methylthio)-5-(phenylmethoxy)-
  • 4(3H)-Pyrimidinone, 2-(methylthio)- (9CI)
  • (1-(1-Methylpyrrolidin-3-yl)piperidin-4-yl)methanamine
  • 2-(3-Hydroxy-1-methylpyrrolidin-3-yl)-2-methylpropanoic acid
  • (2-Amino-4-chlorophenyl)(cyclohexyl)methanone
  • 1-[(2-Amino-5-bromo-3-pyridinyl)sulfonyl]-3-hydroxy-3-azetidinemethanol
  • 2-(1H-indol-3-yl)-4-methyl-Cyclohexanone
  • 3-Benzyl-4-chloro-2-methylpyridine
  • Methyl 1-cyclopropyl-4-oxopyrrolidine-3-carboxylate
  • 7-(1H-indol-3-yl)-1,4-dioxaspiro[4.5]decan-6-ol
  • 4-Pyridineethanamine, N-[3-(aminomethyl)-1-methyl-3-pyrrolidinyl]-N-methyl-
  • CID 64916162
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