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84783-01-7,MFCD02193415
Catalog No.:AA00G3OG

84783-01-7 | Mdk-3017

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
98+%
in stock  
$13.00   $9.00
- +
5mg
98+%
in stock  
$30.00   $21.00
- +
10mg
98+%
in stock  
$45.00   $31.00
- +
50mg
98+%
in stock  
$127.00   $89.00
- +
250mg
95%
in stock  
$625.00   $438.00
- +
1g
95%
in stock  
$1,201.00   $841.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00G3OG
Chemical Name:
Mdk-3017
CAS Number:
84783-01-7
Molecular Formula:
C11H13NOS
Molecular Weight:
207.2920
MDL Number:
MFCD02193415
SMILES:
Oc1ccccc1C(=S)N1CCCC1
Properties
Computed Properties
 
Complexity:
213  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.1  

Downstream Synthesis Route
84783-01-7   
cadmium(II)iodide 
 
Cd(o-hydroxythiobenzopyrrolidide)2I2 

[1]Dubey;Mishra[JournaloftheIndianChemicalSociety,1990,vol.67,#3,p.235-238]

84783-01-7    10108-64-2   
Hg(o-hydroxythiobenzopyrrolidide)Cl2 

[1]Dubey;Mishra[JournaloftheIndianChemicalSociety,1990,vol.67,#3,p.235-238]

84783-01-7    10108-64-2   
Cd(o-hydroxythiobenzopyrrolidide)2Cl2 

[1]Dubey;Mishra[JournaloftheIndianChemicalSociety,1990,vol.67,#3,p.235-238]

84783-01-7   
mercury(II)iodide 
 
Hg(o-hydroxythiobenzopyrrolidide)I2 

[1]Dubey;Mishra[JournaloftheIndianChemicalSociety,1990,vol.67,#3,p.235-238]

84783-01-7   
mercury(II)iodide 
 
Hg(o-hydroxythiobenzopyrrolidide)2I2 

[1]Dubey;Mishra[JournaloftheIndianChemicalSociety,1990,vol.67,#3,p.235-238]

Literature

Title: Sun Q, et al. Discovery of small molecules that bind to K-Ras and inhibit Sos-mediated activation. Angew Chem Int Ed Engl. 2012 Jun 18;51(25):6140-6143

Title: Hocker HJ, et al. LIBSA--a method for the determination of ligand-binding preference to allosteric sites on receptor ensembles. J Chem Inf Model. 2014 Feb 24;54(2):530-538.

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SDS
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Tags:84783-01-7 Molecular Formula|84783-01-7 MDL|84783-01-7 SMILES|84783-01-7 Mdk-3017
Catalog No.: AA00G3OG
84783-01-7,MFCD02193415
84783-01-7 | Mdk-3017
Pack Size： 1mg
Purity： 98+%
in stock
$13.00 $9.00
Pack Size： 5mg
Purity： 98+%
in stock
$30.00 $21.00
Pack Size： 10mg
Purity： 98+%
in stock
$45.00 $31.00
Pack Size： 50mg
Purity： 98+%
in stock
$127.00 $89.00
Pack Size： 250mg
Purity： 95%
in stock
$625.00 $438.00
Pack Size： 1g
Purity： 95%
in stock
$1,201.00 $841.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00G3OG
Chemical Name: Mdk-3017
CAS Number: 84783-01-7
Molecular Formula: C11H13NOS
Molecular Weight: 207.2920
MDL Number: MFCD02193415
SMILES: Oc1ccccc1C(=S)N1CCCC1
Properties
Complexity: 213  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 14  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.1  
Downstream Synthesis Route
84783-01-7   
cadmium(II)iodide 
 
Cd(o-hydroxythiobenzopyrrolidide)2I2 

[1]Dubey;Mishra[JournaloftheIndianChemicalSociety,1990,vol.67,#3,p.235-238]

84783-01-7    10108-64-2   
Hg(o-hydroxythiobenzopyrrolidide)Cl2 

[1]Dubey;Mishra[JournaloftheIndianChemicalSociety,1990,vol.67,#3,p.235-238]

84783-01-7    10108-64-2   
Cd(o-hydroxythiobenzopyrrolidide)2Cl2 

[1]Dubey;Mishra[JournaloftheIndianChemicalSociety,1990,vol.67,#3,p.235-238]

84783-01-7   
mercury(II)iodide 
 
Hg(o-hydroxythiobenzopyrrolidide)I2 

[1]Dubey;Mishra[JournaloftheIndianChemicalSociety,1990,vol.67,#3,p.235-238]

84783-01-7   
mercury(II)iodide 
 
Hg(o-hydroxythiobenzopyrrolidide)2I2 

[1]Dubey;Mishra[JournaloftheIndianChemicalSociety,1990,vol.67,#3,p.235-238]

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