VX-222
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Basic information
- CAS
1026785-59-0- Standard SMILES
CC(C)(C)C#Cc1cc(N(C(=O)[C@H]2CC[C@H](C)CC2)[C@H]2CC[C@@H](O)CC2)c(C(=O)O)s1- InChIKey
WPMJNLCLKAKMLA-UGLKCIBTSA-N- Molecular formula
- C25H35NO4S
- Average molar mass
- 445.62 g/mol
Names & identifiers
- Preferred name
- VX-222
- English name
- VX-222
- Molecular formula
- C25H35NO4S
- Molecular weight
- 445.62
Names & synonyms
VCH222VX-222CS-481VCH-222VCH 222VCH-223)cis-LomibuvirVX-222, VCH222VX222(Lomibuvir)Lomibuvir (VX-222
Database identifiers
- CAS
1026785-59-0
Properties
Physicochemical properties
- Boiling point
- 640.5 · 640.5±55.0 °C(Predicted)
- Density
- 1.21 · 1.21
- storage temp.
- -20 °C · Store at -20°C
- solubility
- 44.6 mg/mL · ≥44.6 mg/mL in DMSO; insoluble in H2O; ≥97.2 mg/mL in EtOH
- form
- solid
- pka
- 3.67 · 3.67±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Applications
DescriptionLomibuvir 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).
UsesVX-222, s a novel, potent and selective inhibitor of HCV polymerase .
Additional notes
DefinitionChEBI: 5-(3,3-dimethylbut-1-ynyl)-3-[(4-hydroxycyclohexyl)-[(4-methylcyclohexyl)-oxomethyl]amino]-2-thiophenecarboxylic acid is a thiophenecarboxylic acid.
Related reactions
0 records
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Compound notes
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