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50508-60-6

50508-60-6 Structure

50508-60-6 Structure
IdentificationBack Directory
[Name]

2-Amino-3-o-chlorobenzoyl-5-ethylthiophene
[CAS]

50508-60-6
[Synonyms]

2-Amino-3-o-chlorobenzoyl-5-ethylthiophene
2-Amino-5-ethyl-3-(2-chlorobenzoyl)thiophene
Methanone,(2-aMino-5-ethyl-3-thienyl)(2-chlorophenyl)-
(2-AMino-5-ethylthiophen-3-yl)(2-chlorophenyl)Methanone
[Molecular Formula]

C13H12ClNOS
[MDL Number]

MFCD04107940
[MOL File]

50508-60-6.mol
[Molecular Weight]

265.758
Chemical PropertiesBack Directory
[Boiling point ]

454.8±45.0 °C(Predicted)
[density ]

1.302
[storage temp. ]

Keep in dark place,Inert atmosphere,Room temperature
[solubility ]

DMF: 10 mg/ml; DMSO: 5 mg/ml; Ethanol: 10 mg/ml; PBS (pH 7.2): insol
[form ]

a crystalline solid
[pka]

-1.81±0.10(Predicted)
Hazard InformationBack Directory
[Chemical Properties]

Yellow Solid
[Uses]

Used in the preparation of thienylamide derivatives as cholecystokinin inhibitors.
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
Questions And AnswerBack Directory
[Description]

2-Amino-3-o-chlorobenzoyl-5-ethylthiophene can be used as the raw material for the synthesis of Etizolam, which is an important sedative hypnotic and antidepressant drug. Its derivative, 2-amino-3-(p-chlorobenzoyl) thiophene scaffold has been widely employed as a pharmacophore for the identification of small molecules acting as allosteric modulators at the adenosine A1 receptor. 
[References]

Kai, Yong Mao, et al. "An Improved Synthesis of Etizolam." Journal of Southwest University of Science & Technology  (2014).
Romagnoli, R, et al. Synthesis and biological evaluation of a new series of 2-amino-3-aroyl thiophene derivatives as agonist allosteric modulators of the A1 adenosine receptor. A position-dependent effect study..Longing for the end. Macmillan, 2015:185–204.
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