Description:
Darunavir Ethanolate is a nonpeptidic HIV protease inhibitor, used to treat HIV infection.
- Molecular Weight: 593.73
- Molecular Formula: C27H37N3O7S·C2H5OH
Purity: >98%
Canonical SMILES:
CCO.CC(C)CN(CC(C(CC1=CC=CC=C1)NC(=O)OC2COC3C2CCO3)O)S(=O)(=O)C4=CC=C(C=C4)N
InChI:
InChI=1S/C27H37N3O7S.C2H6O/c1-18(2)15-30(38(33,34)21-10-8-20(28)9-11-21)16-24(31)23(14-19-6-4-3-5-7-19)29-27(32)37-25-17-36-26-22(25)12-13-35-26;1-2-3/h3-11,18,22-26,31H,12-17,28H2,1-2H3,(H,29,32);3H,2H2,1H3/t22-,23-,24+,25-,26+;/m0./s1
InChIKey: QWSHKNICRJHQCY-VBTXLZOXSA-N
- Melting Point: 99-101°C
- Solubility: In Vitro: DMSO : ≥ 50 mg/mL(84.21 mM)In Vivo: 1.Add each solvent one by one: 10% DMSO >> 40%PEG300 >> 5%Tween-80 >> 45% salineSolubility: ≥ 2.5 mg/mL (4.21 mM); Clear solution2.Add each solvent one by one: 10% DMSO >> 90% (20%SBE-β-CDin saline)Solubility: ≥ 2.5 mg/mL (4.21 mM); Clear solution3.Add each solvent one by one: 10% DMSO >> 90%corn oilSolubility: ≥ 2.5 mg/mL (4.21 mM); Clear solution
- Appearance: White Solid
- Application: HIV Protease Inhibitors
- Storage: Powder: -20°C: 3 years4°C: 2 yearsIn solvent: -80°C: 6 months-20°C: 1 month
Synonyms:
Phosphonoformate
More details are to be found on supplier website
