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Home Amines 1262036-49-6
1262036-49-6,MFCD24387533
Catalog No.:AA009HUC

1262036-49-6 | N-[3-[(4aS,7aS)-2-Amino-5,7-dihydro-4H-furo[3,4-d][1,3]thiazin-7a(4aH)-yl]-4-fluorophenyl]-5-fluoro-2-pyridinecarboxamide hydrochloride

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
98%
in stock  
$25.00   $18.00
- +
5mg
98%
in stock  
$63.00   $44.00
- +
10mg
98%
in stock  
$93.00   $65.00
- +
25mg
98%
in stock  
$158.00   $110.00
- +
50mg
98%
in stock  
$262.00   $184.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA009HUC
Chemical Name:
N-[3-[(4aS,7aS)-2-Amino-5,7-dihydro-4H-furo[3,4-d][1,3]thiazin-7a(4aH)-yl]-4-fluorophenyl]-5-fluoro-2-pyridinecarboxamide hydrochloride
CAS Number:
1262036-49-6
Molecular Formula:
C18H17ClF2N4O2S
Molecular Weight:
426.8680
MDL Number:
MFCD24387533
SMILES:
Fc1ccc(nc1)C(=O)Nc1ccc(c(c1)[C@@]12COC[C@H]2CSC(=N1)N)F.Cl
Properties
Computed Properties
 
Complexity:
610  
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
2  
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
3  
Rotatable Bond Count:
3  

Downstream Synthesis Route

[1]CurrentPatentAssignee:ROCHEHOLDINGAG;ELILILLY&CO-US2011/9395,2011,A1Locationinpatent:Page/Pagecolumn33

[1]CurrentPatentAssignee:ROCHEHOLDINGAG;ELILILLY&CO-US2011/9395,2011,A1Locationinpatent:Page/Pagecolumn33

[2]Hansen,MarvinM.;Jarmer,DanielJ.;Arslantas,Enver;DeBaillie,AmyC.;Frederick,AndreaL.;Harding,Molly;Hoard,DavidW.;Hollister,Adrienne;Huber,Dominique;Kolis,StanleyP.;Kuehne-Willmore,JenniferE.;Kull,Thomas;Laurila,MichaelE.;Linder,RyanJ.;Martin,ThomasJ.;Martinelli,JosephR.;McCulley,MichaelJ.;Richey,RachelN.;Starkey,DerekR.;Ward,JeffreyA.;Zaborenko,Nikolay;Zweifel,Theo[OrganicProcessResearchandDevelopment,2015,vol.19,#9,p.1214-1230]

[1]CurrentPatentAssignee:ROCHEHOLDINGAG;ELILILLY&CO-US2011/9395,2011,A1Locationinpatent:Page/Pagecolumn33

N-((4aS,7aS)-7a-(5-acetamido-2-fluorophenyl)-4a,5,7,7a-tetrahydro-4H-furo3,4-d1,3thiazin-2-yl)benzamide4-methylbenzenesulfonate 
  1262036-49-6 

[1]Hansen,MarvinM.;Jarmer,DanielJ.;Arslantas,Enver;DeBaillie,AmyC.;Frederick,AndreaL.;Harding,Molly;Hoard,DavidW.;Hollister,Adrienne;Huber,Dominique;Kolis,StanleyP.;Kuehne-Willmore,JenniferE.;Kull,Thomas;Laurila,MichaelE.;Linder,RyanJ.;Martin,ThomasJ.;Martinelli,JosephR.;McCulley,MichaelJ.;Richey,RachelN.;Starkey,DerekR.;Ward,JeffreyA.;Zaborenko,Nikolay;Zweifel,Theo[OrganicProcessResearchandDevelopment,2015,vol.19,#9,p.1214-1230]

C21H22FN3O4S 
  1262036-49-6 

[1]Hansen,MarvinM.;Jarmer,DanielJ.;Arslantas,Enver;DeBaillie,AmyC.;Frederick,AndreaL.;Harding,Molly;Hoard,DavidW.;Hollister,Adrienne;Huber,Dominique;Kolis,StanleyP.;Kuehne-Willmore,JenniferE.;Kull,Thomas;Laurila,MichaelE.;Linder,RyanJ.;Martin,ThomasJ.;Martinelli,JosephR.;McCulley,MichaelJ.;Richey,RachelN.;Starkey,DerekR.;Ward,JeffreyA.;Zaborenko,Nikolay;Zweifel,Theo[OrganicProcessResearchandDevelopment,2015,vol.19,#9,p.1214-1230]

[2]Hansen,MarvinM.;Jarmer,DanielJ.;Arslantas,Enver;DeBaillie,AmyC.;Frederick,AndreaL.;Harding,Molly;Hoard,DavidW.;Hollister,Adrienne;Huber,Dominique;Kolis,StanleyP.;Kuehne-Willmore,JenniferE.;Kull,Thomas;Laurila,MichaelE.;Linder,RyanJ.;Martin,ThomasJ.;Martinelli,JosephR.;McCulley,MichaelJ.;Richey,RachelN.;Starkey,DerekR.;Ward,JeffreyA.;Zaborenko,Nikolay;Zweifel,Theo[OrganicProcessResearchandDevelopment,2015,vol.19,#9,p.1214-1230]

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Tags:1262036-49-6 Molecular Formula|1262036-49-6 MDL|1262036-49-6 SMILES|1262036-49-6 N-[3-[(4aS,7aS)-2-Amino-5,7-dihydro-4H-furo[3,4-d][1,3]thiazin-7a(4aH)-yl]-4-fluorophenyl]-5-fluoro-2-pyridinecarboxamide hydrochloride