Home Amines 1160514-60-2
1160514-60-2,MFCD00178741
Catalog No.:AA000BE7

1160514-60-2 | 1H-Pyrazole-4-carboxylic acid, 1-[4-[(2,3,3-trichloro-1-oxo-2-propen-1-yl)amino]phenyl]-5-(trifluoromethyl)-, ethyl ester

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1mg
≥98%
in stock  
$46.00   $32.00
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5mg
≥98%
in stock  
$166.00   $116.00
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10mg
≥98%
in stock  
$242.00   $169.00
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25mg
98% by HPLC
in stock  
$473.00   $331.00
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50mg
98% by HPLC
in stock  
$761.00   $533.00
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100mg
98% by HPLC
in stock  
$1,270.00   $889.00
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500mg
98% by HPLC
in stock  
$3,958.00   $2,771.00
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1000mg
98% by HPLC
in stock  
$6,295.00   $4,407.00
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  • Technical Information
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  • Technical Information
  • Properties
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Technical Information
Catalog Number:
AA000BE7
Chemical Name:
1H-Pyrazole-4-carboxylic acid, 1-[4-[(2,3,3-trichloro-1-oxo-2-propen-1-yl)amino]phenyl]-5-(trifluoromethyl)-, ethyl ester
CAS Number:
1160514-60-2
Molecular Formula:
C16H11Cl3F3N3O3
Molecular Weight:
456.6310
MDL Number:
MFCD00178741
SMILES:
CCOC(=O)c1cnn(c1C(F)(F)F)c1ccc(cc1)NC(=O)C(=C(Cl)Cl)Cl
Properties
Computed Properties
 
Complexity:
621  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
6  
XLogP3:
4.8  

Literature

Title: High-speed microwave-assisted synthesis of the trifluoromethylpyrazol-derived canonical transient receptor potential (TRPC) channel inhibitor Pyr3.

Journal: ChemMedChem 20091101

Title: Selective and direct inhibition of TRPC3 channels underlies biological activities of a pyrazole compound.

Journal: Proceedings of the National Academy of Sciences of the United States of America 20090331

Title: Kiyonaka S, et al. Selective and direct inhibition of TRPC3 channels underlies biological activities of a pyrazole compound. Proc Natl Acad Sci U S A. 2009 Mar 31;106(13):5400-5.

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Tags:1160514-60-2 Molecular Formula|1160514-60-2 MDL|1160514-60-2 SMILES|1160514-60-2 1H-Pyrazole-4-carboxylic acid, 1-[4-[(2,3,3-trichloro-1-oxo-2-propen-1-yl)amino]phenyl]-5-(trifluoromethyl)-, ethyl ester