2-Benzoxazolinone, 3-methyl-6-((4-(alpha,alpha,alpha-trifluoro-m-tolyl)-4-piperazinyl)acetyl)-

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Names

[ CAS No. ]:
82608-05-7

[ Name ]:
2-Benzoxazolinone, 3-methyl-6-((4-(alpha,alpha,alpha-trifluoro-m-tolyl)-4-piperazinyl)acetyl)-

[Synonym ]:
6-<4-(3-trifluoromethylphenyl)-1-piperazinyl>acetyl-3-methyl benzoxazolinone
2(3H)-Benzoxalzolone,3-methyl-6-((4-(3-(trifluoromethyl)phenyl)-1-piperazinyl)acetyl)

Chemical & Physical Properties

[ Density]:
1.348g/cm3

[ Boiling Point ]:
552.6ºC at 760 mmHg

[ Molecular Formula ]:
C21H20F3N3O3

[ Molecular Weight ]:
419.39700

[ Flash Point ]:
288ºC

[ Exact Mass ]:
419.14600

[ PSA ]:
58.69000

[ LogP ]:
3.15810

[ Index of Refraction ]:
1.571

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DM5276530
CHEMICAL NAME :
2-Benzoxazolinone, 3-methyl-6-((4-(alpha,alpha,alpha-trifluoro-m-tolyl)- 4-piperazinyl) acetyl)-
CAS REGISTRY NUMBER :
82608-05-7
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C21-H20-F3-N3-O3
MOLECULAR WEIGHT :
419.44
WISWESSER LINE NOTATION :
T56 BNVOJ B1 GV1- AT6N DNTJ DR CXFFF

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1500 mg/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: 32,604,1982

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 6-(2-bromoacetyl)-3-methyl-2(3H)-benzoxazolone
  • N-(3-Trifluoromethylphenyl)piperazine

DownStream

Related Compounds

  • N-(3,5-dimethoxyphenyl)-2-(4-oxo-2-phenylpyrazolo[1,5-a]pyrazin-5(4H)-yl)acetamide
  • N-(2-chloro-4-methylphenyl)-2-(4-oxo-2-phenylpyrazolo[1,5-a]pyrazin-5(4H)-yl)acetamide
  • N-(2-ethoxyphenyl)-2-(4-oxo-2-phenylpyrazolo[1,5-a]pyrazin-5(4H)-yl)acetamide
  • ethyl 3-{[(4-oxo-2-phenylpyrazolo[1,5-a]pyrazin-5(4H)-yl)acetyl]amino}benzoate
  • N-(4-bromo-2-fluorophenyl)-2-(4-oxo-2-phenylpyrazolo[1,5-a]pyrazin-5(4H)-yl)acetamide
  • N-(4-chlorobenzyl)-2-(4-oxo-2-phenylpyrazolo[1,5-a]pyrazin-5(4H)-yl)acetamide
  • N-(2-chlorobenzyl)-2-(4-oxo-2-phenylpyrazolo[1,5-a]pyrazin-5(4H)-yl)acetamide
  • 2-(4-oxo-2-phenylpyrazolo[1,5-a]pyrazin-5(4H)-yl)-N-(2-phenylethyl)acetamide
  • N-(1,3-benzodioxol-5-ylmethyl)-2-(4-oxo-2-phenylpyrazolo[1,5-a]pyrazin-5(4H)-yl)acetamide
  • N-(2-methoxybenzyl)-2-(4-oxo-2-phenylpyrazolo[1,5-a]pyrazin-5(4H)-yl)acetamide
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