Product Details of 88-68-6. Fernandez, GA; Castro, EF; Rosas, RA; Fidalgo, DM; Adler, NS; Battini, L; de Marco, MEJ; Fabiani, M; Bruno, AM; Bollini, M; Cavallaro, LV in [Fernandez, Gabriela A.; Fidalgo, Daniela M.; Adler, Natalia S.; Battini, Leandro; Bollini, Mariela] Ctr Invest Bionanociencias CIBION, Lab Quim Med, Consejo Nacl Invest Cient Tecn CONICET, Buenos Aires, DF, Argentina; [Castro, Eliana F.] Ctr Invest Ciencias Vet & Agro, Inst Virol & Innovac Tecnol, Inst Nacl Tecnol Agropecuaria, Consejo Nacl Invest Cient & Tecn CONICET, Buenos Aires, DF, Argentina; [Castro, Eliana F.; Espana de Marco, Maria J.] Univ Buenos Aires, Fac Farm & Bioquim, Dept Microbiol Inmunol Biotecnol & Genet, Buenos Aires, DF, Argentina; [Rosas, Rocio A.; Fabiani, Matias; Cavallaro, Lucia V.] Univ Buenos Aires, Inst Invest Bacteriol & Virol Mol IBaViM, Dept Microbiol Inmunol Biotecnol & Genet, Catedra Virol,Fac Farm & Bioquim, Buenos Aires, DF, Argentina; [Rosas, Rocio A.; Fabiani, Matias] Consejo Nacl Invest Cient & Tecn CONICET, Buenos Aires, DF, Argentina; [Bruno, Ana M.] Univ Buenos Aires, Fac Farm & Bioquim, Dept Quim Organ, Buenos Aires, DF, Argentina published Design and Optimization of Quinazoline Derivatives: New Non-nucleoside Inhibitors of Bovine Viral Diarrhea Virus in 2020, Cited 54. The Name is 2-Aminobenzamide. Through research, I have a further understanding and discovery of 88-68-6.
Bovine viral diarrhea virus (BVDV) belongs to the Pestivirus genus (Flaviviridae). In spite of the availability of vaccines, the virus is still causing substantial financial losses to the livestock industry. In this context, the use of antiviral agents could be an alternative strategy to control and reduce viral infections. The viral RNA-dependent RNA polymerase (RdRp) is essential for the replication of the viral genome and constitutes an attractive target for the identification of antiviral compounds. In a previous work, we have identified potential molecules that dock into an allosteric binding pocket of BVDV RdRp via a structure-based virtual screening approach. One of them, N-(2-morpholinoethyl)-2-phenylquinazolin-4-amine [1, 50% effective concentration (EC50) = 9.7 +/- 0.5 mu M], was selected to perform different chemical modifications. Among 24 derivatives synthesized, eight of them showed considerable antiviral activity. Molecular modeling of the most active compounds showed that they bind to a pocket located in the fingers and thumb domains in BVDV RdRp, which is different from that identified for other non-nucleoside inhibitors (NNIs) such as thiosemicarbazone (TSC). We selected compound 2-[4-(2-phenylquinazolin-4-yl)piperazin-1-yl]ethanol (1.9; EC50 = 1.7 +/- 0.4 mu M) for further analysis. Compound 1.9 was found to inhibit the in vitro replication of TSC-resistant BVDV variants, which carry the N264D mutation in the RdRp. In addition, 1.9 presented adequate solubility in different media and a high-stability profile in murine and bovine plasma.
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Thiomorpholine – Wikipedia,
,Thiomorpholine | C4H9NS – PubChem