2-[4-[2-(1,3-benzodioxol-5-yl)ethyl]piperazin-1-yl]pyrimidine,dihydrochloride

Names

[ CAS No. ]:
21279-52-7

[ Name ]:
2-[4-[2-(1,3-benzodioxol-5-yl)ethyl]piperazin-1-yl]pyrimidine,dihydrochloride

Chemical & Physical Properties

[ Boiling Point ]:
487ºC at 760 mmHg

[ Molecular Formula ]:
C17H22Cl2N4O2

[ Molecular Weight ]:
385.28800

[ Flash Point ]:
248.3ºC

[ Exact Mass ]:
384.11200

[ PSA ]:
50.72000

[ LogP ]:
3.17690

[ Vapour Pressure ]:
1.23E-09mmHg at 25°C

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UV9334000
CHEMICAL NAME :
Pyrimidine, 2-(4-(3,4-(methylenedioxy)phenethyl)-1-piperazinyl)-, dihydrochloride, hydrate
CAS REGISTRY NUMBER :
21279-52-7
LAST UPDATED :
198612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C17-H20-N4-O2.2Cl-H.H2-O
MOLECULAR WEIGHT :
402.34
WISWESSER LINE NOTATION :
T56 BO DO CHJ G2- AT6N DNTJ D- BT6N CNJ &GH 2 &QH

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 :
Behavioral - analgesia Biochemical - Metabolism (Intermediary) - effect on inflammation or mediation of inflammation
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 11,1151,1968

Related Compounds

  • N-[4-(2,6-dimethylmorpholin-4-yl)sulfonylphenyl]-5-(2-hydroxyphenyl)pyrazolidine-3-carboxamide
  • N-(6-ethoxy-1,3-benzothiazol-2-yl)-5-(2-hydroxyphenyl)pyrazolidine-3-carboxamide
  • 5-(2-hydroxyphenyl)-N-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]pyrazolidine-3-carboxamide
  • N-[4-(2-ethylpiperidin-1-yl)sulfonylphenyl]-5-(2-hydroxyphenyl)pyrazolidine-3-carboxamide
  • N-(1,3-benzodioxol-5-ylmethyl)-5-(2-hydroxyphenyl)pyrazolidine-3-carboxamide
  • 5-(2-hydroxyphenyl)-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]pyrazolidine-3-carboxamide
  • 5-(2-hydroxyphenyl)-N-[(4-methoxyphenyl)methyl]pyrazolidine-3-carboxamide
  • 5-(2-hydroxyphenyl)-N-[2-(4-methylbenzoyl)-1-benzofuran-3-yl]pyrazolidine-3-carboxamide
  • N-(2-benzoyl-1-benzofuran-3-yl)-5-(2-hydroxyphenyl)pyrazolidine-3-carboxamide
  • 3-(5-Chloro-2-hydroxy-4-methylphenyl)-4-(4-ethoxyphenyl)-5-[2-(4-methoxyphenyl)ethyl]-1,2,3,3a,4,6a-hexahydropyrrolo[3,4-c]pyrazol-6-one
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