Elsulfavirine
CAS Number: 868046-19-9
Molecular Mass: 629.3 g/mol
Formula: C24H17BrCl2FN3O5S
Smiles: CCC(=O)NS(=O)(=O)C1=CC(=C(C=C1)NC(=O)CC2=C(C(=C(C=C2)Br)OC3=CC(=CC(=C3)C#N)Cl)F)Cl
Synonymes: Elsulfavirine, N-[4-[[2-[4-Bromo-3-(3-chloro-5-cyanophenoxy)-2-fluorophenyl]acetyl]amino]-3-chlorophenyl]sulfonylpropanamide, Elpida, VM-1500
Bioactivity: Non-nucleoside reverse transcriptase inhibitor. Currently, elsulfavirine is used in antiretroviral therapy regimens in the Russian Federation.
Solubility in Different Solvents
| Solvent | Temperature [K] | Crystal form | Solubility [mg/mL] | Reference |
|---|---|---|---|---|
| Cyclohexane | 298.0 | Monoclinic polymorph | 0.00003? | None |
| Acetonitrile | 298.0 | Monoclinic polymorph | 3.44? | None |
Thermodynamic parameters of solution
| Solvent | Temperature [K] | Crystal form | ΔHsol [kJ/mol] | ΔSsol [J/mol/K] | ΔGsol [kJ/mol] | Reference |
|---|---|---|---|---|---|---|
| Cyclohexane | 298.0 | Monoclinic polymorph | - | - | 140.7 | - |
| Acetonitrile | 298.0 | Monoclinic polymorph | - | - | 12.9 | - |