Bedaquiline (Mixture of Diastereomers)

• Synonyms:

  6-Bromo-α-[2-(dimethylamino)ethyl]-2-methoxy-α-1-naphthalenyl-β-phenyl-3-quinolineethanol

• Hazard Statement:

  May cause an allergic skin reaction

• Purity:

  >95% (HPLC)

• Smiles:

  COc1nc2ccc(Br)cc2cc1C(c3ccccc3)C(O)(CCN(C)C)c4cccc5ccccc45

• Molecular Formula:

  C32 H31 Br N2 O2

• Molecular Weight:

  555.5

• InChI:

  InChI=1S/C32H31BrN2O2/c1-35(2)19-18-32(36,28-15-9-13-22-10-7-8-14-26(22)28)30(23-11-5-4-6-12-23)27-21-24-20-25(33)16-17-29(24)34-31(27)37-3/h4-17,20-21,30,36H,18-19H2,1-3H3

• Additionnal Information:

  IUPAC name: 1-(6-bromo-2-methoxy-3-quinolyl)-4-(dimethylamino)-2-(1-naphthyl)-1-phenyl-butan-2-ol

• Shipping Conditions:

  Room Temperature

• Storage Conditions:

  -20°C

• CAS Number:

  654655-80-8