rac-N-Desmethyl Bedaquiline

• CAT Number: R014454
• CAS Number: 654654-76-9
• Molecular Formula: C31H29BrN2O2
• Molecular Weight: 541.489
• Purity: ≥95%
• Synonyms: rac-(1R,2S)-1-(6-Bromo-2-methoxyquinolin-3-yl)-4-(methylamino)-2-(naphthalen-1-yl)-1-phenylbutan-2-ol; (αR,βS)-rel-6-Bromo-2-methoxy-α-[2-(methylamino)ethyl]-α-1-naphthalenyl-β-phenyl-3-quinolineethanol
• Storage: Store at +4°C
• IUPAC Name: (1R,2S)-1-(6-bromo-2-methoxyquinolin-3-yl)-4-(methylamino)-2-naphthalen-1-yl-1-phenylbutan-2-ol
• InChI: InChI=1S/C31H29BrN2O2/c1-33-18-17-31(35,27-14-8-12-21-9-6-7-13-25(21)27)29(22-10-4-3-5-11-22)26-20-23-19-24(32)15-16-28(23)34-30(26)36-2/h3-16,19-20,29,33,35H,17-18H2,1-2H3/t29-,31-/m1/s1
• InChIKey: GOBOQBZOZDRXCQ-BVRKHOPBSA-N
• SMILES: CNCCC(C1=CC=CC2=CC=CC=C21)(C(C3=CC=CC=C3)C4=C(N=C5C=CC(=CC5=C4)Br)OC)O

rac-N-Desmethyl Bedaquiline (CAS 654654-76-9)  is used in the synthesis of Bedaquiline, a diarylquinoline derivative that acts as a mycobacterial inhibitor. Bedaquiline shows promise as potential drug in the treatment of tuberculosis.