DBG-3A Dihexyl Mesylate

CAS: 1643392-59-9

Ref. TR-D136535

Produktinformation

• Name: DBG-3A Dihexyl Mesylate
• Synonyme: (Z)-Ethyl 3-(3-(((Hexyloxy)carbonyl)amino)-4-(2-((4-(N'-((hexyloxy)carbonyl)carbamimidoyl)phenyl)amino)-N-methylacetamido)-N-(pyridin-2-yl)benzamido)propanoate methanesulfonat
• Marke: TRC
• Beschreibung: Applications DBG-3A Dihexyl Mesylate is a Dabigatran (D100090) Impurity. Dabigatran is an antithrombotic.References Hauel, N., et al.: J. Med. Chem., 45, 1757 (2002), Mungall, D., et al.: Curr. Opin. Invest. Drugs, 3, 095 (2002), Stangier, J., et al.: J. Clin. Pharmacol., 45, 555 (2005), Anon.: IP.com J., 14,1 (2014)

Chemische Eigenschaften

• Molekulargewicht: 869.39933
• Formel: C₄₁H₅₅N₇O₈•(CH₄O₃S)
• Farbe/Form: Neat
• InChl: InChI=1S/C41H55N7O8.CH4O3S/c1-5-8-10-14-26-55-40(52)45-33-28-31(39(51)48(25-23-37(50)54-7-3)35-16-12-13-24-43-35)19-22-34(33)47(4)36(49)29-44-32-20-17-30(18-21-32)38(42)46-41(53)56-27-15-11-9-6-2;1-5(2,3)4/h12-13,16-22,24,28,44H,5-11,14-15,23,25-27,29H2,1-4H3,(H,45,52)(H2,42,46,53);1H3,(H,2,3,4)
• InChI Key: InChIKey=UFDLHQLRFMSLEM-UHFFFAOYSA-N
• SMILES: CCCCCCOC(=O)/N=C(\N)c1ccc(NCC(=O)N(C)c2ccc(C(=O)N(CCC(=O)OCC)c3ccccn3)cc2NC(=O)OCCCCCC)cc1.CS(=O)(=O)O