For research use only. Not for therapeutic Use.
Rac 8-Hydroxy Efavirenz-d4 (Cat No.:C000858) is a racemic mixture of deuterium-labeled 8-hydroxy efavirenz, a derivative of the antiretroviral drug efavirenz. The “d4” notation indicates that four hydrogen atoms in the molecule are replaced with deuterium, a stable isotope of hydrogen. This labeling allows researchers to study the metabolism, pharmacokinetics, and interactions of efavirenz in biological systems accurately. Rac 8-Hydroxy Efavirenz-d4 is a valuable tool in pharmaceutical research, aiding in the understanding of drug effects, improving drug design, and advancing the treatment of HIV infections.
Catalog Number | C000858 |
CAS Number | 1246812-30-5 |
Synonyms | 6-Chloro-4-(cyclopropyl-d4-ethynyl)-1,4-dihydro-8-hydroxy-4-(trifluoromethyl)-2H-3,1-benzoxazin-2-one; 8-Hydroxyefavirenz; |
Molecular Formula | C₁₄H₅D₄ClF₃NO₃ |
Purity | ≥95% |
Solubility | DMSO (Slightly), Methanol (Slightly) |
Appearance | White to Off-White Solid |
Storage | -20°C |
IUPAC Name | 6-chloro-8-hydroxy-4-[2-(2,2,3,3-tetradeuteriocyclopropyl)ethynyl]-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one |
InChI | InChI=1S/C14H9ClF3NO3/c15-8-5-9-11(10(20)6-8)19-12(21)22-13(9,14(16,17)18)4-3-7-1-2-7/h5-7,20H,1-2H2,(H,19,21)/i1D2,2D2 |
InChIKey | OOVOMPCQLMFEDT-LNLMKGTHSA-N |
SMILES | C1CC1C#CC2(C3=C(C(=CC(=C3)Cl)O)NC(=O)O2)C(F)(F)F |
Reference | Gorski, J., et al.: Biochem. Pharmacol., 47, 1643 (1994), Desta, Z., et al.: J. Pharmacol. Exp. Ther., 285, 428 (1998), Langmann, P., et al.: Eur. J. Med. Res., 7, 309(2002), Chang, T., et al.: Drug Metab. Dispos., 31, 7 (2003), |