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Home > Encyclopedia > 2′-Deoxy-4′-C-ethynyl-2-fluoroadenosine

2′-Deoxy-4′-C-ethynyl-2-fluoroadenosine

2′-Deoxy-4′-C-ethynyl-2-fluoroadenosine structure

2′-Deoxy-4′-C-ethynyl-2-fluoroadenosine 

structure
  • CAS No:

    865363-93-5

  • Formula:

    C12H12FN5O3

  • Chemical Name:

    2′-Deoxy-4′-C-ethynyl-2-fluoroadenosine

  • Synonyms:

    Adenosine,2′-deoxy-4′-C-ethynyl-2-fluoro-;2′-Deoxy-4′-C-ethynyl-2-fluoroadenosine;4′-Ethynyl-2-fluoro-2′-deoxyadenosine;MK 8591;Islatravir;1189790-66-6

Description

Islatravir is under investigation in clinical trial NCT04233216 (Doravirine/islatravir (DOR/ISL) in Heavily Treatment-experienced (HTE) Participants for Human Immunodeficiency Virus Type 1 (HIV-1) Infection (MK-8591A-019)).

2′-Deoxy-4′-C-ethynyl-2-fluoroadenosine Basic Attributes

293.25

293.25

QPQ082R25D

Characteristics

119.31000

-0.22710

1.72±0.1 g/cm3

220.0-221.4 °C (decomp)

669.2±65.0 °C(Predicted)

13.11±0.60

Drug Information

Treatment of human immunodeficiency virus (HIV-1) infection

Agents used to treat RETROVIRIDAE INFECTIONS. (See all compounds classified as Anti-Retroviral Agents.)|Agents used in the prophylaxis or therapy of VIRUS DISEASES. Some of the ways they may act include preventing viral replication by inhibiting viral DNA polymerase; binding to specific cell-surface receptors and inhibiting viral penetration or uncoating; inhibiting viral protein synthesis; or blocking late stages of virus assembly. (See all compounds classified as Antiviral Agents.)|Compounds or agents that combine with an enzyme in such a manner as to prevent the normal substrate-enzyme combination and the catalytic reaction. (See all compounds classified as Enzyme Inhibitors.)|Compounds that inhibit cell production of DNA or RNA. (See all compounds classified as Nucleic Acid Synthesis Inhibitors.)|Inhibitors of reverse transcriptase (RNA-DIRECTED DNA POLYMERASE), an enzyme that synthesizes DNA on an RNA template. (See all compounds classified as Reverse Transcriptase Inhibitors.)

2'-deoxy-4'-ethynyl-2-fluoroadenosine

2′-Deoxy-4′-C-ethynyl-2-fluoroadenosine Use and Manufacturing

Human Drugs -> EU pediatric investigation plans

Computed Properties

Molecular Weight:293.25
XLogP3:-0.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:3
Exact Mass:293.09241742
Monoisotopic Mass:293.09241742
Topological Polar Surface Area:119
Heavy Atom Count:21
Complexity:459
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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