Ledipasvir

Catalog Number: BC-0794

CAS Number: 1256388-51-8

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Specifications

Product Information
Molecular Formula	C₄₉H₅₄F₂N₈O₆
Molecular Weight	889.0
Purity	≥98% by HPLC
SMILES	CC(C)C(C(=O)N1CC2(CC2)CC1C3=NC=C(N3)C4=CC5=C(C=C4)C6=C(C5(F)F)C=C(C=C6)C7=CC8=C(C=C7)N=C(N8) C9C1CCC(C1)N9C(=O)C(C(C)C)NC(=O)OC)NC(=O)OC
InChi	InChI=1S/C49H54F2N8O6/c1-24(2)39(56-46(62)64-5)44(60)58-23-48(15-16-48)21-38(58)42-52-22-37(55-42)28-9-13-32-31-12-8-26(18-33(31) 49(50,51)34(32)19-28)27-10-14-35-36(20-27)54-43(53-35)41-29-7-11-30(17-29)59(41)45(61)40(25(3)4) 57-47(63)65-6/h8-10,12-14,18-20,22,24-25,29-30,38-41H,7,11,15-17,21,23H2,1-6H3,(H,52,55)(H,53,54) (H,56,62)(H,57,63)/t29-,30+,38-,39-,40-,41-/m0/s1
InChi Key	VRTWBAAJJOHBQU-KMWAZVGDSA-N
Alternate Name	GS-5885,Harvoni,Methyl N-[(2S)-1-[(6S)-6-[5-[9,9-Difluoro-7-[2-[(1S,2S,4R)-3-[(2S)-2-(methoxycarbonylamino) -3-methylbutanoyl]-3-azabicyclo[2.2.1]heptan-2-yl]-3H-benzimidazol-5-yl]fluoren-2-yl]-1H-imidazol-2-yl] -5-azaspiro[2.4]heptan-5-yl]-3-methyl-1-oxobu
Appearance	Off-white solid

Properties
Storage Conditions	-20°C
Shipping Conditions	Gel Pack
Solubility	>10 mg/ml (DMSO)

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