2-[2-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxo-ethyl]sulfanyl-3-(3-fluo rophenyl)quinazolin-4-one

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Names

[ CAS No. ]:
81262-74-0

[ Name ]:
2-[2-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxo-ethyl]sulfanyl-3-(3-fluo rophenyl)quinazolin-4-one

Chemical & Physical Properties

[ Density]:
1.38g/cm3

[ Boiling Point ]:
716.4ºC at 760 mmHg

[ Molecular Formula ]:
C26H22ClFN4O2S

[ Molecular Weight ]:
508.99500

[ Flash Point ]:
387.1ºC

[ Exact Mass ]:
508.11400

[ PSA ]:
83.74000

[ LogP ]:
4.62200

[ Index of Refraction ]:
1.68

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TL2810300
CHEMICAL NAME :
Piperazine, 1-(4-chlorophenyl)-4-(((3-(3-fluorophenyl)-3,4-dihydr o-4-oxo-2-quinazoliny l) thio)acetyl)-
CAS REGISTRY NUMBER :
81262-74-0
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C26-H22-Cl-F-N4-O2-S
MOLECULAR WEIGHT :
509.03

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 :
>1 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 32,24,1982

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 3-(3-fluorophenyl)-2-mercaptoquinazolin-4(3H)-one
  • piperazine, 1-(chloroacetyl)-4-(4-chlorophenyl)-

DownStream

Related Compounds

  • tert-butyl N-{3-hydroxy-4-[1-(hydroxymethyl)cyclobutyl]phenyl}carbamate
  • 4-(3-Bromo-4-methylthiophen-2-yl)-1,3-oxazolidin-2-one
  • rac-(1R,2S)-2-(4-methoxynaphthalen-1-yl)cyclopropan-1-amine
  • 1-(4-bromo-3,5-dimethylphenyl)-N-methylcyclopropan-1-amine
  • 3-Amino-1-(5-bromo-2-cyclopropylpyrimidin-4-yl)propan-1-ol
  • Methyl 3-amino-2-(2,6-difluoro-3-methylphenyl)propanoate
  • 3-(1-Chloroisoquinolin-3-yl)-1,1,1-trifluoropropan-2-amine
  • tert-butyl N-[2-(1-aminoethyl)-4-chlorophenyl]carbamate
  • 1-(2-Methoxy-6-methylpyridin-4-yl)-2-(methylamino)ethan-1-ol
  • 1-[(1,3-dimethyl-1H-pyrazol-5-yl)methyl]cyclopropan-1-ol
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