N,N-Bis[(2R)​-​3-​(1,​3-​dihydro-​1,​3-​dioxo-​2H-​isoindol-​2-​yl)​-​2-​[(1H-​imidazol-​1-​ylcarbonyl)​oxy]​propyl]-4-​(3-oxo-4-morpholinyl)aniline

CAS: 2097255-05-3

Ref. TR-D452563

Product Information

• Name: N,N-Bis[(2R)​-​3-​(1,​3-​dihydro-​1,​3-​dioxo-​2H-​isoindol-​2-​yl)​-​2-​[(1H-​imidazol-​1-​ylcarbonyl)​oxy]​propyl]-4-​(3-oxo-4-morpholinyl)aniline
• Synonyms: Rivaroxaban Impurity 76

Description

Stability Not stable in Solution
Applications (1R)​-​2-​(1,​3-​Dihydro-​1,​3-​dioxo-​2H-​isoindol-​2-​yl)​-​1-​[[[(2R)​-​3-​(1,​3-​dihydro-​1,​3-​dioxo-​2H-​isoindol-​2-​yl)​-​2-​[(1H-​imidazol-​1-​ylcarbonyl)​oxy]​propyl]​[4-​(3-​oxo-​4-​morpholinyl)​phenyl]​amino]​methyl]​ethyl ester 1H-​Imidazole-​1-​carboxylic Acid is an impurity of Rivaroxaban (R538000), a novel antithrombotic agent that is highly potent and selective.
References Ansell, J., et al.: Drugs, 64, 1 (2004), Eriksson, B., et al.: J. Thromb. Haemost., 3, 103 (2005), Kubitza, D., et al.: Clin. Pharmacol. Ther., 78, 412 (2005),

• Brand: TRC

Chemical properties

• Molecular weight: 786.75
• Formula: C₄₀H₃₄N₈O₁₀
• Color/Form: Off-White to Light Yellow Solid
• InChI: InChI=1S/C40H34N8O10/c49-34-23-56-18-17-46(34)27-11-9-26(10-12-27)45(19-28(57-39(54)43-15-13-41-24-43)21-47-35(50)30-5-1-2-6-31(30)36(47)51)20-29(58-40(55)44-16-14-42-25-44)22-48-37(52)32-7-3-4-8-33(32)38(48)53/h1-16,24-25,28-29H,17-23H2/t28-,29-/m1/s1
• InChI key: InChIKey=PICQBDSICPMTCI-FQLXRVMXSA-N
• SMILES: O=C1c2ccccc2C(=O)N1C[C@@H](CN(C[C@H](CN1C(=O)c2ccccc2C1=O)OC(=O)n1ccnc1)c1ccc(N2CCOCC2=O)cc1)OC(=O)n1ccnc1