Letermovir

For research use only. Not for therapeutic Use.

  • CAT Number: I005468
  • CAS Number: 917389-32-3
  • Molecular Formula: C29H28F4N4O4
  • Molecular Weight: 572.60
  • Purity: 98%
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Letermovir(Cat No.:I005468)is a potent antiviral agent primarily used for the prevention of cytomegalovirus (CMV) infection in hematopoietic stem cell transplant (HSCT) recipients. It acts as a selective inhibitor of the CMV terminase complex, which is crucial for viral DNA cleavage and packaging. By targeting this enzyme, Letermovir prevents the replication of CMV, reducing the risk of CMV reactivation. Its well-established safety profile and efficacy make it an essential option in post-transplant immunocompromised patients, helping mitigate the complications associated with CMV infection.


Catalog Number I005468
CAS Number 917389-32-3
Synonyms

2-[(4S)-8-fluoro-2-[4-(3-methoxyphenyl)piperazin-1-yl]-3-[2-methoxy-5-(trifluoromethyl)phenyl]-4H-quinazolin-4-yl]acetic acid

Molecular Formula C29H28F4N4O4
Purity 98%
Target CMV
Solubility 10 mM in DMSO
Appearance Solid Powder
Storage Store at -20°C
Analysis method HPLC
IC50 5.1±1.2 nM (EC50, HCMV-AD169 strain, CPE reduction assay)
IUPAC Name 2-[(4S)-8-fluoro-2-[4-(3-methoxyphenyl)piperazin-1-yl]-3-[2-methoxy-5-(trifluoromethyl)phenyl]-4H-quinazolin-4-yl]acetic acid
InChI InChI=1S/C29H28F4N4O4/c1-40-20-6-3-5-19(16-20)35-11-13-36(14-12-35)28-34-27-21(7-4-8-22(27)30)23(17-26(38)39)37(28)24-15-18(29(31,32)33)9-10-25(24)41-2/h3-10,15-16,23H,11-14,17H2,1-2H3,(H,38,39)/t23-/m0/s1
InChIKey FWYSMLBETOMXAG-QHCPKHFHSA-N
SMILES COC1=C(C=C(C=C1)C(F)(F)F)N2[C@H](C3=C(C(=CC=C3)F)N=C2N4CCN(CC4)C5=CC(=CC=C5)OC)CC(=O)O
Reference

1: Erb-Zohar K, Kropeit D, Scheuenpflug J, Stobernack HP, Hulskotte E, van Schanke A, Zimmermann H, R&uuml;bsamen-Schaeff H. Intravenous Hydroxypropyl &beta;-Cyclodextrin Formulation of Letermovir: A Phase I, Randomized, Single-Ascending, and Multiple-Dose Trial. Clin Transl Sci. 2017 Nov;10(6):487-495. doi: 10.1111/cts.12483. Epub 2017 Jul 4. PubMed PMID: 28675594.<br />
2: Bowman LJ, Melaragno JI, Brennan DC. Letermovir for the management of cytomegalovirus infection. Expert Opin Investig Drugs. 2017 Feb;26(2):235-241. doi: 10.1080/13543784.2017.1274733. Epub 2016 Dec 28. Review. PubMed PMID: 27998189.<br />
3: Wildum S, Zimmermann H, Lischka P. In vitro drug combination studies of Letermovir (AIC246, MK-8228) with approved anti-human cytomegalovirus (HCMV) and anti-HIV compounds in inhibition of HCMV and HIV replication. Antimicrob Agents Chemother. 2015;59(6):3140-8. doi: 10.1128/AAC.00114-15. Epub 2015 Mar 16. PubMed PMID: 25779572; PubMed Central PMCID: PMC4432118.<br />
4: Goldner T, Hempel C, Ruebsamen-Schaeff H, Zimmermann H, Lischka P. Geno- and phenotypic characterization of human cytomegalovirus mutants selected in vitro after letermovir (AIC246) exposure. Antimicrob Agents Chemother. 2014;58(1):610-3. doi: 10.1128/AAC.01794-13. Epub 2013 Nov 4. PubMed PMID: 24189264; PubMed Central PMCID: PMC3910730.<br />
5: Goldner T, Hewlett G, Ettischer N, Ruebsamen-Schaeff H, Zimmermann H, Lischka P. The novel anticytomegalovirus compound AIC246 (Letermovir) inhibits human cytomegalovirus replication through a specific antiviral mechanism that involves the viral terminase. J Virol. 2011 Oct;85(20):10884-93. doi: 10.1128/JVI.05265-11. Epub 2011 Jul 13. PubMed PMID: 21752907; PubMed Central PMCID: PMC3187482.

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