1,2-Bis[2-(4-Dibenzo[b,f][1,4]thiazepin-11-yl-1-piperazinyl)ethoxy]ethane-d16

CAS: 1371638-05-9

Ref. TR-B419122

Produktinformation

• Name: 1,2-Bis[2-(4-Dibenzo[b,f][1,4]thiazepin-11-yl-1-piperazinyl)ethoxy]ethane-d16
• Synonyme: 6-[4-[2-[2-[2-(4-benzo[b][1,4]benzothiazepin-6-yl-2,2,3,3,5,5,6,6-octadeuteriopiperazin-1-yl)ethoxy]ethoxy]ethyl]-2,2,3,3,5,5,6,6-octadeuteriopiperazin-1-yl]benzo[b][1,4]benzothiazepine

Beschreibung

Applications Isotope labelled 1,2-Bis[2-(4-Dibenzo[b,f][1,4]thiazepin-11-yl-1-piperazinyl)ethoxy]ethane is an impurity of Quetiapine (Q510000), an atypical antipsychotic agent used for the treatment of patients with schizophrenia, biopolar disorder and to treat major depressive disorder.
References Kumar, K., et al.: Org. Chem. Indian. J., 8, 164 (2012);

• Marke: TRC

Chemische Eigenschaften

• Molekulargewicht: 721.045
• Formel: C₄₀D₁₆H₂₈N₆O₂S₂
• Farbe/Form: Neat
• InChl: InChI=1S/C40H44N6O2S2/c1-5-13-35-31(9-1)39(41-33-11-3-7-15-37(33)49-35)45-21-17-43(18-22-45)25-27-47-29-30-48-28-26-44-19-23-46(24-20-44)40-32-10-2-6-14-36(32)50-38-16-8-4-12-34(38)42-40/h1-16H,17-30H2/i17D2,18D2,19D2,20D2,21D2,22D2,23D2,24D2
• InChI Key: InChIKey=YBVWRXGWAIZGDD-YCTFEWCQSA-N
• SMILES: [2H]C1([2H])N(CCOCCOCCN2C([2H])([2H])C([2H])([2H])N(C3=Nc4ccccc4Sc4ccccc43)C([2H])([2H])C2([2H])[2H])C([2H])([2H])C([2H])([2H])N(C2=Nc3ccccc3Sc3ccccc32)C1([2H])[2H]