N-[3-Amino-4-(methylamino)benzoyl]-N-2-pyridinyl-Beta-alanine Ethyl Ester

CAS: 212322-56-0

Ref. TR-A611990

Product Information

• Name: N-[3-Amino-4-(methylamino)benzoyl]-N-2-pyridinyl-Beta-alanine Ethyl Ester
• Synonyms: Ethyl 3-((3-amino-4-methylaminobenzoyl)-(pyridin-2-yl)-amino)propanoate, 3-[(3-Amino-4-Methylamino-Benzoyl)-Pyridin-2-Yl-Amino]-Propionic Acid Ethyl Ester, 3-[(3-Amino-4-methyl aminobenzoyl)pyridin-2-ylamino]propionic acid ethyl ester, 3-[(3-Amino-4-methylaminobenzoyl)pyridin-2-ylamino]propionic acid ethyl ester, 3-[3-Amino-4-(Methylaminobenzoyl)-Pyridin-2-Ylamni]Propionic Acid Ethyl Ester, Alanine,N-[3-amino-4-(methylamino)benzoyl]-N-2-pyridinyl-,ethyl ester, Dabigatran etexilate intermediates, Dabigatran intermediates, Ethyl 3-(3-amino-4-(methylamino)-N-(pyridin-2-yl)benzamido)propanoate, Ethyl 3-[(3-amino-4-methylaminobenzoyl)-(pyridin-2-yl)-amino]propanoate, Ethyl 3-[3-amino-4-(methylamino)-N-(pyridin-2-yl)benzoylamino]propanoate, Ethyl 3-[[3-amino-4-(methylamino)benzoyl](pyridin-2-yl)amino]propionate, Ethyl 3-[[3-amino-4-(methylamino)benzoyl]-pyridin-2-ylamino]propanoate, N-[3-amino-4-(methylamino)benzoyl]-N-2-pyridinyl-beta-Alanine ethyl ester, N-[3-amino-4-(methylamino)benzoyl]-N-2-pyridinyl-β-alanine, ethyl ester, b-Alanine, N-[3-amino-4-(methylamino)benzoyl]-N-2-pyridinyl-, ethyl ester
• CAS: 212322-56-0

Description

Applications N-[3-Amino-4-(methylamino)benzoyl]-N-2-pyridinyl-β-alanine Ethyl Ester is used in the synthesis of Dabigatran Etexilate, an oral anticoagulant and direct thrombin inhibitor.
References Mangiafico, R. et al.: Curr. Med. Chem., 19, 4688 (2012); Hu, Z. et al.: Anal. Bioanal. Chem., 405, 1695 (2013);

• Brand: TRC

Chemical properties

• Molecular weight: 342.39
• Formula: C₁₈H₂₂N₄O₃
• Color/Form: Off-White to Pale Beige Solid
• InChI: InChI=1S/C18H22N4O3/c1-3-25-17(23)9-11-22(16-6-4-5-10-21-16)18(24)13-7-8-15(20-2)14(19)12-13/h4-8,10,12,20H,3,9,11,19H2,1-2H3
• InChI key: InChIKey=PCPATNZTKBOKOY-UHFFFAOYSA-N
• SMILES: CCOC(=O)CCN(C(=O)c1ccc(NC)c(N)c1)c1ccccn1