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Doravirine

Basic information Safety Supplier Related

Doravirine Basic information

Product Name:
Doravirine
Synonyms:
  • MK-1439
  • 3-chloro-5-((1-((4-Methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)Methyl)-2-oxo-4-(trifluoroMethyl)-1,2-dihydropyridin-3-yl)oxy)benzonitrile
  • 3-Chloro-5-[[1-[(4,5-dihydro-4-methyl-5-oxo-1H-1,2,4-triazol-3-yl)methyl]-1,2-dihydro-2-oxo-4-(trifluoromethyl)-3-pyridinyl]oxy]benzonitrile
  • Doravirine / MK-1439
  • Doravirine
  • MK-1439(Doravirine)
  • Benzonitrile, 3-chloro-5-[[1-[(4,5-dihydro-4-methyl-5-oxo-1H-1,2,4-triazol-3-yl)methyl]-1,2-dihydro-2-oxo-4-(trifluoromethyl)-3-pyridinyl]oxy]-
  • 3-chloro-5-[1-[(4-methyl-5-oxo-1H-1,2,4-triazol-3-yl)methyl]-2-oxo-4-(trifluoromethyl)pyridin-3-yl]oxybenzonitrile
CAS:
1338225-97-0
MF:
C17H11ClF3N5O3
MW:
425.75
Mol File:
1338225-97-0.mol
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Doravirine Chemical Properties

Melting point:
>278°C (dec.)
Density 
1.56±0.1 g/cm3(Predicted)
storage temp. 
-20°C Freezer
solubility 
DMSO (Slightly, Heated), Methanol (Slightly, Heated)
form 
Solid
pka
8.04±0.20(Predicted)
color 
White to Off-White
InChI
InChI=1S/C17H11ClF3N5O3/c1-25-13(23-24-16(25)28)8-26-3-2-12(17(19,20)21)14(15(26)27)29-11-5-9(7-22)4-10(18)6-11/h2-6H,8H2,1H3,(H,24,28)
InChIKey
ZIAOVIPSKUPPQW-UHFFFAOYSA-N
SMILES
C(#N)C1=CC(OC2=C(C(F)(F)F)C=CN(CC3N(C)C(=O)NN=3)C2=O)=CC(Cl)=C1
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Doravirine Usage And Synthesis

Uses

Doravirine is a novel non-nucleoside inhibitor of HIV-1 reverse transcriptase with potent activity against wild-type virus.

in vivo

Administration of 50 mg Doravirine with a high-fat meal is associated with slight elevations in AUC time zero to infinity and C24 h with no change in Cmax[2].

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