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Doravirine

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Doravirine / CAS : 1338225-97-0

Appearance White to Off-White Solid UN -
HS - DG Class -
Synonyms MK-1439; Pifeltro; Doravirine (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-Methyl-5-oxo-1H-1,2,4-Triazol-3-yl)Methyl]-2-oxo-4-(Trifluoromethyl)Pyridin-3-yl]Oxybenzonitrile; MK1439; Mk-1439a; 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; 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)-; 4ncg; Pifeltro (TN); 2KW; MK 1439; MK-1439(Doravirine); D0R0TS; Delstrigo Component Doravirine; Doravirine Component OF Delstrigo; 3-Chloro-5-[[1-[(4-Methyl-5-oxo-1H-1,2,4-Triazol-3-yl)Methyl]-2-oxo-4-(Trifluoromethyl)-3-Pyridyl]oxy]Benzonitrile
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Properties

Summary

Formula
C17H11ClF3N5O3
Molecular Mass
425.74900
Exact Mass
425.05000
PSA
105.70000
Logp
2.65458
IUPAC
3-chloro-5-[1-[(4-methyl-5-oxo-1H-1,2,4-triazol-3-yl)methyl]-2-oxo-4-(trifluoromethyl)pyridin-3-yl]oxybenzonitrile
SMILES
CN1C(=NNC1=O)CN2C=CC(=C(C2=O)OC3=CC(=CC(=C3)C#N)Cl)C(F)(F)F

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Inhibitors

Chemical and Physical Properties

Melting Point
>278°C (dec.)
Appearance
White to Off-White Solid

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