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ChemicalBook--->CAS DataBase List--->1026785-59-0

1026785-59-0

1026785-59-0 Structure

1026785-59-0 Structure
IdentificationBack Directory
[Name]

VX-222
[CAS]

1026785-59-0
[Synonyms]

VCH222
VX-222
CS-481
VCH 222
VCH-222
VX-222, VCH222
VX222(Lomibuvir)
Lomibuvir (VX-222
VX-222 (VCH-222, LoMibuvir)
Lomibuvir (VX-222, VCH-222)
VCH222; VX 222; VCH 222; VCH-222;VX-222
5-(3,3-Dimethyl-1-butyn-1-yl)-3-[(cis-4-hydroxycyclohexyl)[(trans-4-methylcyclohexyl)carbonyl]amino]-2-thiophenecarboxylic acid
2-Thiophenecarboxylic acid, 5-(3,3-dimethyl-1-butyn-1-yl)-3-[(cis-4-hydroxycyclohexyl)[(trans-4-methylcyclohexyl)carbonyl]amino]-
[Molecular Formula]

C25H35NO4S
[MDL Number]

MFCD18089858
[MOL File]

1026785-59-0.mol
[Molecular Weight]

445.61
Chemical PropertiesBack Directory
[Boiling point ]

640.5±55.0 °C(Predicted)
[density ]

1.21
[storage temp. ]

Store at -20°C
[solubility ]

≥44.6 mg/mL in DMSO; insoluble in H2O; ≥97.2 mg/mL in EtOH
[form ]

solid
[pka]

3.67±0.10(Predicted)
Safety DataBack Directory
[Symbol(GHS) ]


GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
Hazard InformationBack Directory
[Description]

Lomibuvir is a non-nucleoside inhibitor of the RNA-directed RNA polymerase of hepatitis C virus (HCV; Ki = 17 nM) that inhibits primer-dependent RNA synthesis selectively over de novo RNA synthesis. It inhibits HCV replication in Huh7.5 cells expressing the 1b/Con1 HCV subgenomic replicon (EC50 = 5 nM).
[Uses]

VX-222, s a novel, potent and selective inhibitor of HCV polymerase .
[Definition]

ChEBI: 5-(3,3-dimethylbut-1-ynyl)-3-[(4-hydroxycyclohexyl)-[(4-methylcyclohexyl)-oxomethyl]amino]-2-thiophenecarboxylic acid is a thiophenecarboxylic acid.
[target]

HCV RNA-dependent RNA polymerase
Spectrum DetailBack Directory
[Spectrum Detail]

VX-222(1026785-59-0)1HNMR
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