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Home Amines 59729-32-7
59729-32-7,MFCD02101306
Catalog No.:AA00IAIQ

59729-32-7 | (S)-1-(3-(dimethylamino)propyl)-1-(4-fluorophenyl)-1,3-dihydroisobenzofuran-5-carbonitrile hydrobromide

Pack Size
Purity
Availability
Price(USD)
Quantity
  
25mg
99%(HPLC)
in stock  
$43.00   $30.00
- +
1g
98 - 102% (Assay, on anhydrous basis)
in stock  
$61.00   $43.00
- +
5g
98 - 102% (Assay, on anhydrous basis)
in stock  
$97.00   $68.00
- +
25g
98 - 102% (Assay, on anhydrous basis)
in stock  
$266.00   $186.00
- +
100g
98 - 102% (Assay, on anhydrous basis)
in stock  
$653.00   $457.00
- +
250g
98 - 102% (Assay, on anhydrous basis)
in stock  
$1,224.00   $857.00
- +
  • Technical Information
  • Properties
  • Literature
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA00IAIQ
Chemical Name:
(S)-1-(3-(dimethylamino)propyl)-1-(4-fluorophenyl)-1,3-dihydroisobenzofuran-5-carbonitrile hydrobromide
CAS Number:
59729-32-7
Molecular Formula:
C20H22BrFN2O
Molecular Weight:
405.3039
MDL Number:
MFCD02101306
SMILES:
N#Cc1ccc2c(c1)COC2(CCCN(C)C)c1ccc(cc1)F.Br
NSC Number:
758684
Properties
Properties
 
Form:
Solid  
MP:
182-188 °C  
Storage:
Inert atmosphere;2-8℃;  

Computed Properties
 
Complexity:
466  
Covalently-Bonded Unit Count:
2  
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
5  
Undefined Atom Stereocenter Count:
1  

Literature

Title: Species comparison of in vivo P-glycoprotein-mediated brain efflux using mdr1a-deficient rats and mice.

Journal: Drug metabolism and disposition: the biological fate of chemicals 20120301

Title: Genetic mapping of targets mediating differential chemical phenotypes in Plasmodium falciparum.

Journal: Nature chemical biology 20091001

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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SDS
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Tags:59729-32-7 Molecular Formula|59729-32-7 MDL|59729-32-7 SMILES|59729-32-7 (S)-1-(3-(dimethylamino)propyl)-1-(4-fluorophenyl)-1,3-dihydroisobenzofuran-5-carbonitrile hydrobromide