2-[[5-(2-ethoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]cyclohexene-1-carboxylic acid

Names

[ Name ]:
2-[[5-(2-ethoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]cyclohexene-1-carboxylic acid

[Synonym ]:
2-((5-(2-Ethoxyphenyl)-1,3,4-thiadiazol-2-yl)amino)-1-cyclohexene-1-carboxylic acid
1-Cyclohexene-1-carboxylic acid,2-((5-(2-ethoxyphenyl)-1,3,4-thiadiazol-2-yl)amino)

Chemical & Physical Properties

[ Density]:
1.356g/cm3

[ Boiling Point ]:
543ºC at 760mmHg

[ Molecular Formula ]:
C₁₇H₁₉N₃O₃S

[ Molecular Weight ]:
345.41600

[ Flash Point ]:
282.2ºC

[ Exact Mass ]:
345.11500

[ PSA ]:
115.81000

[ LogP ]:
3.35030

[ Vapour Pressure ]:
1.26E-12mmHg at 25°C

[ Index of Refraction ]:
1.651

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: GW4392500

CHEMICAL NAME :: 1-Cyclohexene-1-carboxylic acid, 2-((5-(2-ethoxyphenyl)-1,3,4-thiadiazol-2-yl)amino)-

CAS REGISTRY NUMBER :: 160893-98-1

LAST UPDATED :: 199603

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C17-H19-N3-O3-S

MOLECULAR WEIGHT :: 345.45

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 :: PHARAT Pharmazie. (VEB Verlag Volk und Gesundheit, Neue Gruenstr. 18, Berlin DDR-1020, Ger. Dem. Rep.) V.1- 1946- Volume(issue)/page/year: 49,880,1994

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 250 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: PHARAT Pharmazie. (VEB Verlag Volk und Gesundheit, Neue Gruenstr. 18, Berlin DDR-1020, Ger. Dem. Rep.) V.1- 1946- Volume(issue)/page/year: 49,880,1994

Synthetic Route

Click to get detail synthetic route

Related Compounds

4-(1H-Pyrazol-1-yl)-8-oxabicyclo[3.2.1]octan-2-one
6-Amino-1H-indole-5-carboxylic acid
ethyl 2-(2-((1-(2-(diethylamino)-2-oxoethyl)-1H-indol-3-yl)thio)acetamido)acetate
Nolomirole, (S)-
N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-(morpholine-4-sulfonyl)benzamide
5-Bromo-3-ethyl-6-methylpyridin-2-amine
1-[[5-(Nonyloxy)pentyl]oxy]nonane
5-Formylnaphthalene-1-carboxylic acid
1-(3,4-Dichlorophenyl)-2-(propan-2-ylsulfanyl)ethan-1-one
3-Methyl-N-propyl-1H-indol-1-amine

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