817204-32-3,MFCD23106344
Catalog No.:AA00ID4O

817204-32-3 | (2'R)-N-Benzoyl-2'-deoxy-2'-fluoro-2'-methylcytidine 3',5'-dibenzoate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
10g
95%
in stock  
$24.00   $17.00
- +
25g
95%
in stock  
$47.00   $33.00
- +
50g
95%
in stock  
$92.00   $65.00
- +
100g
97%
in stock  
$154.00   $108.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00ID4O
Chemical Name:
(2'R)-N-Benzoyl-2'-deoxy-2'-fluoro-2'-methylcytidine 3',5'-dibenzoate
CAS Number:
817204-32-3
Molecular Formula:
C31H26FN3O7
Molecular Weight:
571.5524
MDL Number:
MFCD23106344
SMILES:
O=C(c1ccccc1)O[C@@H]1[C@@H](COC(=O)c2ccccc2)O[C@H]([C@]1(C)F)n1ccc(nc1=O)NC(=O)c1ccccc1
Properties
Computed Properties
 
Complexity:
1080  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
4  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
42  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
10  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
4.3  

Downstream Synthesis Route

[1]CurrentPatentAssignee:GILEADSCIENCESINC-WO2013/178571,2013,A1Locationinpatent:Page/Pagecolumn12

[2]CurrentPatentAssignee:GILEADSCIENCESINC-US2013/324709,2013,A1Locationinpatent:Paragraph0053;0054

[3]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2008/45419,2008,A1Locationinpatent:Page/Pagecolumn11-12

[4]Locationinpatent:experimentalpartWang,Peiyuan;Chun,Byoung-Kwon;Rachakonda,Suguna;Du,Jinfa;Khan,Noshena;Shi,Junxing;Stec,Wojciech;Cleary,Darryl;Ross,BruceS.;Sofia,MichaelJ.[JournalofOrganicChemistry,2009,vol.74,#17,p.6819-6824]

[5]Clark,JeremyL.;Hollecker,Laurent;Mason,J.Christian;Stuyver,LievenJ.;Tharnish,PhillipM.;Lostia,Stefania;McBrayer,TamaraR.;Schinazi,RaymondF.;Watanabe,KyoichiA.;Otto,MichaelJ.;Furman,PhillipA.;Stec,WojciechJ.;Patterson,StevenE.;Pankiewicz,KrzysztofW.[JournalofMedicinalChemistry,2005,vol.48,#17,p.5504-5508]

[6]CurrentPatentAssignee:GILEADSCIENCESINC-US2013/273005,2013,A1Locationinpatent:Paragraph0360

[7]CurrentPatentAssignee:ENANTAPHARMACEUTICALSINC-WO2013/173759,2013,A2Locationinpatent:Page/Pagecolumn138

817204-32-3   
(2‘R)-2‘-deoxy-2’-fluoro-2-methyluridine-3’,5’-dibenzoate 

[1]CurrentPatentAssignee:FUZHOUXINGCHENPHARAMCEUTICAL-CN106810515,2017,ALocationinpatent:Paragraph0057;0059-0060

[2]CurrentPatentAssignee:ZHEJIANGA&FUNIVERSITY-CN106905398,2017,ALocationinpatent:Paragraph0038;0046

[3]CurrentPatentAssignee:GILEADSCIENCESINC-US2010/16251,2010,A1Locationinpatent:Page/Pagecolumn35

[4]Maiti,Munmun;Maiti,Mohitosh;Rozenski,Jef;DeJonghe,Steven;Herdewijn,Piet[OrganicandBiomolecularChemistry,2015,vol.13,#18,p.5158-5174]

[5]CurrentPatentAssignee:OPTIMUSDRUGSP-WO2018/15821,2018,A1Locationinpatent:Page/Pagecolumn5;8

[6]Locationinpatent:experimentalpartSofia,MichaelJ.;Bao,Donghui;Chang,Wonsuk;Du,Jinfa;Nagarathnam,Dhanapalan;Rachakonda,Suguna;Reddy,P.Ganapati;Ross,BruceS.;Wang,Peiyuan;Zhang,Hai-Ren;Bansal,Shalini;Espiritu,Christine;Keilman,Meg;Lam,AngelaM.;Steuer,HollyM.Micolochick;Niu,Congrong;Otto,MichaelJ.;Furman,PhillipA.[JournalofMedicinalChemistry,2010,vol.53,#19,p.7202-7218]

[7]CurrentPatentAssignee:GILEADSCIENCESINC-WO2010/135569,2010,A1Locationinpatent:Page/Pagecolumn39-40

[8]Clark,JeremyL.;Hollecker,Laurent;Mason,J.Christian;Stuyver,LievenJ.;Tharnish,PhillipM.;Lostia,Stefania;McBrayer,TamaraR.;Schinazi,RaymondF.;Watanabe,KyoichiA.;Otto,MichaelJ.;Furman,PhillipA.;Stec,WojciechJ.;Patterson,StevenE.;Pankiewicz,KrzysztofW.[JournalofMedicinalChemistry,2005,vol.48,#17,p.5504-5508]

[9]CurrentPatentAssignee:NANJINGSANHOMEINVESTMENTGROUPCOLTD-CN108218937,2018,ALocationinpatent:Paragraph0089-0091

[10]CurrentPatentAssignee:NANJINGSANHOMEINVESTMENTGROUPCOLTD-CN108201539,2018,ALocationinpatent:Paragraph0033;0034;0035

[11]CurrentPatentAssignee:NANTONGCHANGYOOPHARMATECH;NANTONGCHANGYOUPHARMACEUTICALTECHNOLOGY-CN104610404,2016,BLocationinpatent:Paragraph0045;0046;0061;0062;0076;0077

[12]CurrentPatentAssignee:ANHUIBIOCHEMUNITEDPHARMACEUTICALCO.,LTD.-CN103848876,2016,BLocationinpatent:Paragraph0106;0107

863329-62-8   
N4-benzoyl-1-2-deoxy-2-methylidene-3,5-di-O-benzoyl-β-D-glycero-pentofuranosylcytosine 
  817204-32-3   
N4-benzoyl-2'-C-methyl-3',5'-di-O-benzoylcytidine 

[1]Clark,JeremyL.;Hollecker,Laurent;Mason,J.Christian;Stuyver,LievenJ.;Tharnish,PhillipM.;Lostia,Stefania;McBrayer,TamaraR.;Schinazi,RaymondF.;Watanabe,KyoichiA.;Otto,MichaelJ.;Furman,PhillipA.;Stec,WojciechJ.;Patterson,StevenE.;Pankiewicz,KrzysztofW.[JournalofMedicinalChemistry,2005,vol.48,#17,p.5504-5508]

914912-73-5    817204-32-3   
(2R,3R,4R,5S)-5-(4-benzoylamino-2-oxopyrimidin-1(2H)-yl)-2-((benzoyloxy)methyl)-4-fluoro-4-methyltetrahydrofuran-3-ylbenzoate 

[1]Clark,JeremyL.;Mason,J.Christian;Hobbs,AnnJ.;Hollecker,Laurent;Schinazi,RaymondF.[JournalofCarbohydrateChemistry,2006,vol.25,#6,p.461-470]

(2R)-2-deoxy-2-fluoro-2-methyl-α/β-D-erythro-pentofuranosylchloride-3,5-dibenzoate 
  85743-99-3    817204-32-3 

[1]CurrentPatentAssignee:JIANGSUALPHARMPHARMACEUTICALGROUP-CN113354700,2021,ALocationinpatent:Paragraph0043-0045;0054-0056

[2]CurrentPatentAssignee:FUZHOUXINGCHENPHARAMCEUTICAL-CN106810515,2017,ALocationinpatent:Paragraph0050;0052-0053

[3]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2008/45419,2008,A1Locationinpatent:Page/Pagecolumn9-11

[4]CurrentPatentAssignee:GILEADSCIENCESINC-WO2013/178571,2013,A1Locationinpatent:Page/Pagecolumn11;12

[5]CurrentPatentAssignee:GILEADSCIENCESINC-US2013/324709,2013,A1Locationinpatent:Paragraph0051;0052

Literature
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Additional Info:
SDS
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Tags:817204-32-3 Molecular Formula|817204-32-3 MDL|817204-32-3 SMILES|817204-32-3 (2'R)-N-Benzoyl-2'-deoxy-2'-fluoro-2'-methylcytidine 3',5'-dibenzoate
Catalog No.: AA00ID4O
817204-32-3,MFCD23106344
817204-32-3 | (2'R)-N-Benzoyl-2'-deoxy-2'-fluoro-2'-methylcytidine 3',5'-dibenzoate
Pack Size: 10g
Purity: 95%
in stock
$24.00 $17.00
Pack Size: 25g
Purity: 95%
in stock
$47.00 $33.00
Pack Size: 50g
Purity: 95%
in stock
$92.00 $65.00
Pack Size: 100g
Purity: 97%
in stock
$154.00 $108.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00ID4O
Chemical Name: (2'R)-N-Benzoyl-2'-deoxy-2'-fluoro-2'-methylcytidine 3',5'-dibenzoate
CAS Number: 817204-32-3
Molecular Formula: C31H26FN3O7
Molecular Weight: 571.5524
MDL Number: MFCD23106344
SMILES: O=C(c1ccccc1)O[C@@H]1[C@@H](COC(=O)c2ccccc2)O[C@H]([C@]1(C)F)n1ccc(nc1=O)NC(=O)c1ccccc1
Properties
Complexity: 1080  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 4  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 42  
Hydrogen Bond Acceptor Count: 8  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 10  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 4.3  
Downstream Synthesis Route
817204-32-3    817204-33-4 

[1]CurrentPatentAssignee:GILEADSCIENCESINC-WO2013/178571,2013,A1Locationinpatent:Page/Pagecolumn12

[2]CurrentPatentAssignee:GILEADSCIENCESINC-US2013/324709,2013,A1Locationinpatent:Paragraph0053;0054

[3]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2008/45419,2008,A1Locationinpatent:Page/Pagecolumn11-12

[4]Locationinpatent:experimentalpartWang,Peiyuan;Chun,Byoung-Kwon;Rachakonda,Suguna;Du,Jinfa;Khan,Noshena;Shi,Junxing;Stec,Wojciech;Cleary,Darryl;Ross,BruceS.;Sofia,MichaelJ.[JournalofOrganicChemistry,2009,vol.74,#17,p.6819-6824]

[5]Clark,JeremyL.;Hollecker,Laurent;Mason,J.Christian;Stuyver,LievenJ.;Tharnish,PhillipM.;Lostia,Stefania;McBrayer,TamaraR.;Schinazi,RaymondF.;Watanabe,KyoichiA.;Otto,MichaelJ.;Furman,PhillipA.;Stec,WojciechJ.;Patterson,StevenE.;Pankiewicz,KrzysztofW.[JournalofMedicinalChemistry,2005,vol.48,#17,p.5504-5508]

[6]CurrentPatentAssignee:GILEADSCIENCESINC-US2013/273005,2013,A1Locationinpatent:Paragraph0360

[7]CurrentPatentAssignee:ENANTAPHARMACEUTICALSINC-WO2013/173759,2013,A2Locationinpatent:Page/Pagecolumn138

817204-32-3   
(2‘R)-2‘-deoxy-2’-fluoro-2-methyluridine-3’,5’-dibenzoate 

[1]CurrentPatentAssignee:FUZHOUXINGCHENPHARAMCEUTICAL-CN106810515,2017,ALocationinpatent:Paragraph0057;0059-0060

[2]CurrentPatentAssignee:ZHEJIANGA&FUNIVERSITY-CN106905398,2017,ALocationinpatent:Paragraph0038;0046

[3]CurrentPatentAssignee:GILEADSCIENCESINC-US2010/16251,2010,A1Locationinpatent:Page/Pagecolumn35

[4]Maiti,Munmun;Maiti,Mohitosh;Rozenski,Jef;DeJonghe,Steven;Herdewijn,Piet[OrganicandBiomolecularChemistry,2015,vol.13,#18,p.5158-5174]

[5]CurrentPatentAssignee:OPTIMUSDRUGSP-WO2018/15821,2018,A1Locationinpatent:Page/Pagecolumn5;8

[6]Locationinpatent:experimentalpartSofia,MichaelJ.;Bao,Donghui;Chang,Wonsuk;Du,Jinfa;Nagarathnam,Dhanapalan;Rachakonda,Suguna;Reddy,P.Ganapati;Ross,BruceS.;Wang,Peiyuan;Zhang,Hai-Ren;Bansal,Shalini;Espiritu,Christine;Keilman,Meg;Lam,AngelaM.;Steuer,HollyM.Micolochick;Niu,Congrong;Otto,MichaelJ.;Furman,PhillipA.[JournalofMedicinalChemistry,2010,vol.53,#19,p.7202-7218]

[7]CurrentPatentAssignee:GILEADSCIENCESINC-WO2010/135569,2010,A1Locationinpatent:Page/Pagecolumn39-40

[8]Clark,JeremyL.;Hollecker,Laurent;Mason,J.Christian;Stuyver,LievenJ.;Tharnish,PhillipM.;Lostia,Stefania;McBrayer,TamaraR.;Schinazi,RaymondF.;Watanabe,KyoichiA.;Otto,MichaelJ.;Furman,PhillipA.;Stec,WojciechJ.;Patterson,StevenE.;Pankiewicz,KrzysztofW.[JournalofMedicinalChemistry,2005,vol.48,#17,p.5504-5508]

[9]CurrentPatentAssignee:NANJINGSANHOMEINVESTMENTGROUPCOLTD-CN108218937,2018,ALocationinpatent:Paragraph0089-0091

[10]CurrentPatentAssignee:NANJINGSANHOMEINVESTMENTGROUPCOLTD-CN108201539,2018,ALocationinpatent:Paragraph0033;0034;0035

[11]CurrentPatentAssignee:NANTONGCHANGYOOPHARMATECH;NANTONGCHANGYOUPHARMACEUTICALTECHNOLOGY-CN104610404,2016,BLocationinpatent:Paragraph0045;0046;0061;0062;0076;0077

[12]CurrentPatentAssignee:ANHUIBIOCHEMUNITEDPHARMACEUTICALCO.,LTD.-CN103848876,2016,BLocationinpatent:Paragraph0106;0107

863329-62-8   
N4-benzoyl-1-2-deoxy-2-methylidene-3,5-di-O-benzoyl-β-D-glycero-pentofuranosylcytosine 
  817204-32-3   
N4-benzoyl-2'-C-methyl-3',5'-di-O-benzoylcytidine 

[1]Clark,JeremyL.;Hollecker,Laurent;Mason,J.Christian;Stuyver,LievenJ.;Tharnish,PhillipM.;Lostia,Stefania;McBrayer,TamaraR.;Schinazi,RaymondF.;Watanabe,KyoichiA.;Otto,MichaelJ.;Furman,PhillipA.;Stec,WojciechJ.;Patterson,StevenE.;Pankiewicz,KrzysztofW.[JournalofMedicinalChemistry,2005,vol.48,#17,p.5504-5508]

914912-73-5    817204-32-3   
(2R,3R,4R,5S)-5-(4-benzoylamino-2-oxopyrimidin-1(2H)-yl)-2-((benzoyloxy)methyl)-4-fluoro-4-methyltetrahydrofuran-3-ylbenzoate 

[1]Clark,JeremyL.;Mason,J.Christian;Hobbs,AnnJ.;Hollecker,Laurent;Schinazi,RaymondF.[JournalofCarbohydrateChemistry,2006,vol.25,#6,p.461-470]

(2R)-2-deoxy-2-fluoro-2-methyl-α/β-D-erythro-pentofuranosylchloride-3,5-dibenzoate 
  85743-99-3    817204-32-3 

[1]CurrentPatentAssignee:JIANGSUALPHARMPHARMACEUTICALGROUP-CN113354700,2021,ALocationinpatent:Paragraph0043-0045;0054-0056

[2]CurrentPatentAssignee:FUZHOUXINGCHENPHARAMCEUTICAL-CN106810515,2017,ALocationinpatent:Paragraph0050;0052-0053

[3]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2008/45419,2008,A1Locationinpatent:Page/Pagecolumn9-11

[4]CurrentPatentAssignee:GILEADSCIENCESINC-WO2013/178571,2013,A1Locationinpatent:Page/Pagecolumn11;12

[5]CurrentPatentAssignee:GILEADSCIENCESINC-US2013/324709,2013,A1Locationinpatent:Paragraph0051;0052

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