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Danoprevir

Catalog No.: 16070107
Cas No.: 850876-88-9
Purity : 98% by HPLC 
16070107 - Danoprevir | CAS 850876-88-9

Catalog number : 16070107

CAS number : 850876-88-9

Molecular Formula : C35H46FN5O9S 

Molecular Weight : 731.83 

Iupac Chemical Name : (2R,13aS,14aR,16aS,Z)-6-((tert-butoxycarbonyl)amino)-14a-((cyclopropylsulfonyl)carbamoyl)-5,16-dioxo-1,2,3,5,6,7,8,9,10,11,13a,14,14a,15,16,16a-hexadecahydrocyclopropa[e]pyrrolo[1,2-a][1,4]diazacyclopentadecin-2-yl 4-fluoroisoindoline-2-carboxylate 

Smile : FC1=C2CN(CC2=CC=C1)C(=O)O[C@@H]1C[C@@H]2N(C(C(CCCCC\C=C/[C@H]3[C@](NC2=O)(C3)C(NS(=O)(=O)C3CC3)=O)NC(=O)OC(C)(C)C)=O)C1

InChiKey : ZVTDLPBHTSMEJZ-QIFYYAQYSA-N

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SynonymsRG7227; RG 7227; 
Molecular FormulaC35H46FN5O9S 
Molecular Weight731.83 
AppearanceSolid powder 
Purity98% by HPLC 
SolubilitySoluble in DMSO 
Storage-20 ºC for 3 years 
Shipping ConditionShipped under ambient temperature 
SmileFC1=C2CN(CC2=CC=C1)C(=O)O[C@@H]1C[C@@H]2N(C(C(CCCCC\C=C/[C@H]3[C@](NC2=O)(C3)C(NS(=O)(=O)C3CC3)=O)NC(=O)OC(C)(C)C)=O)C1
InChiKeyZVTDLPBHTSMEJZ-QIFYYAQYSA-N
InChiInChI=1S/C35H46FN5O9S/c1-34(2,3)50-32(45)37-27-13-8-6-4-5-7-11-22-17-35(22,31(44)39-51(47,48)24-14-15-24)38-29(42)28-16-23(19-41(28)30(27)43)49-33(46)40-18-21-10-9-12-26(36)25(21)20-40/h7,9-12,22-24,27-28H,4-6,8,13-20H2,1-3H3,(H,37,45)(H,38,42)(H,39,44)/b11-7-/t22-,23-,27?,28+,35-/m1/s1
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Danoprevir, also known as ITMN-191 and RG-7227, is under development by InterMune Inc and Roche Holding AG, is a promising, potent NS3/4A protease inhibitor for the oral treatment of HCV infection. Preclinical data demonstrated that danoprevir binds with high affinity and dissociates slowly from the HCV NS3 protease, allowing high liver drug exposure with only modest plasma drug exposure. A phase Ib, 'IFN-free' clinical trial demonstrated that danoprevir, combined with the HCV polymerase inhibitor RG-7128 (Pharmasset Inc/Roche Holding AG), was effective in reducing HCV-RNA levels in a large proportion of treatment-naÃve patients with HCV infection and in approximately half of previously non-responsive patients with HCV-1 infection, without resistance or safety concerns. 

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