1-[[2-[5-(3,4-dimethoxyphenyl)tetrazol-2-yl]acetyl]amino]-3-(4-ethoxyphenyl)thiourea

Names

[ CAS No. ]:
94771-98-9

[ Name ]:
1-[[2-[5-(3,4-dimethoxyphenyl)tetrazol-2-yl]acetyl]amino]-3-(4-ethoxyphenyl)thiourea

Chemical & Physical Properties

[ Density]:
1.38g/cm3

[ Molecular Formula ]:
C20H23N7O4S

[ Molecular Weight ]:
457.50600

[ Exact Mass ]:
457.15300

[ PSA ]:
167.07000

[ LogP ]:
3.09840

[ Index of Refraction ]:
1.653

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XF7463620
CHEMICAL NAME :
2H-Tetrazole-2-acetic acid, 5-(3,4-dimethoxyphenyl)-, 2-(((4-ethoxyphenyl)amino)thioxomethyl) hydrazide
CAS REGISTRY NUMBER :
94771-98-9
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C20-H23-N7-O4-S
MOLECULAR WEIGHT :
457.56
WISWESSER LINE NOTATION :
5NNNNJ B1VMMYUS&MR DO2& ER CO1 DO1

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 :
500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
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: 23,1133,1984
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
PHMGBN Pharmacology: International Journal of Experimental and Clinical Pharmacology. (S. Karger AG, Postfach CH-4009 Basel, Switzerland) V.1- 1968- Volume(issue)/page/year: 35,333,1987

Synthetic Route

Click to get detail synthetic route

Related Compounds

  • 1-Tert-butyl-4-(oxan-4-yl)pyrrolidine-3-carboxylic acid
  • 1-Tert-butyl-4-methylpyrrolidine-3-carboxylic acid
  • Methyl tricyclo[4.2.0.02,5]octane-3-carboxylate
  • 1-Tert-butyl-4-(1,3-thiazol-4-yl)pyrrolidine-3-carboxylic acid
  • 1-tert-butyl-4-(1-methyl-1H-imidazol-4-yl)pyrrolidine-3-carboxylic acid
  • 1-Cyclobutyl-4-(pyridin-3-yl)pyrrolidine-3-carboxylic acid
  • 2-[1-[2-(3,5-Dimethyl-1,2-oxazol-4-yl)ethyl]benzimidazol-2-yl]ethanamine;dihydrochloride
  • 1-{6-Azabicyclo[3.2.1]octan-3-yl}-3-propylurea
  • 2-[2-(2-aminoethyl)-1H-1,3-benzodiazol-1-yl]acetamide dihydrochloride
  • N-(2-ethoxyethyl)aniline hydrochloride
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