N-(2-((Methylamino)carbonyl)benzoyl) amlodipine

Base Information

• Chemical Name: N-(2-((Methylamino)carbonyl)benzoyl) amlodipine
• CAS No.: 721958-72-1
• Molecular Formula: C29H32ClN3O7
• Molecular Weight: 570.042
• European Community (EC) Number: 642-063-2
• UNII: 436R8SHM18
• DSSTox Substance ID: DTXSID301100767
• Wikidata: Q27258617
• Mol file: 721958-72-1.mol

Synonyms:721958-72-1;Amlodipine besilate impurity B;N-(2-((Methylamino)carbonyl)benzoyl) amlodipine;3-Ethyl 5-methyl 4-(2-chlorophenyl)-6-methyl-2-((2-(2-(methylcarbamoyl)-benzamido)ethoxy)methyl)-1,4-dihydropyridine-3,5-dicarboxylate;Amlodipine EP Impurity B;3-ethyl 5-Methyl 4-(2-chlorophenyl)-6-Methyl-2-((2-(2-(MethylcarbaMoyl)benzaMido)ethoxy)Methyl)-1,4-dihydropyridine-3,5-dicarboxylate;UNII-436R8SHM18;3-Ethyl 5-methyl (4RS)-4-(2-chlorophenyl)-6-methyl-2-((2-((2-(methylcarbamoyl)benzoyl)amino)ethoxy)methyl)-1,4-dihydropyridine-3,5-dicarboxylate;436R8SHM18;N-[2-[(Methylamino)carbonyl]benzoyl] Amlodipine;Amlodipine besilate impurity B [EP];(+/-)-N-(2-((Methylamino)carbonyl)benzoyl) amlodipine;N-[2-[(METHYLAMINO)CARBONYL]BENZOYL];3-Ethyl 5-Methyl (4RS)-4-(2-Chlorophenyl)-6-methyl-2-[[2-[[2-(methylcarbamoyl)benzoyl]amino]ethoxy]methyl]-1,4-dihydropyridine-3,5-dicarboxylate;Amlodipine Besilate Imp. B (EP);Amlodipine Imp. B (EP);Amlodipine Related Compound B;Amlodipine Besilate Impurity B;Amlodipine Impurity B;DTXSID301100767;AKOS027250805;5-O-ethyl 3-O-methyl 4-(2-chlorophenyl)-2-methyl-6-[2-[[2-(methylcarbamoyl)benzoyl]amino]ethoxymethyl]-1,4-dihydropyridine-3,5-dicarboxylate;AS-48147;CS-0299208;FT-0671454;EN300-734904;F19271;A899919;AMLODIPINE BESILATE IMPURITY B [EP IMPURITY];Q27258617;Z2937742979;3,5-PYRIDINEDICARBOXYLIC ACID, 4-(2-CHLOROPHENYL)-1,4-DIHYDRO-2-METHYL-6-((2-((2-((METHYLAMINO)CARBONYL)BENZOYL)AMINO)ETHOXY)METHYL)-, 5-ETHYL 3-METHYL ESTER;3-ETHYL 5-METHYL 4-(2-CHLOROPHENYL)-6-METHYL-2-[(2-{[2-(METHYLCARBAMOYL)PHENYL]FORMAMIDO}ETHOXY)METHYL]-1,4-DIHYDROPYRIDINE-3,5-DICARBOXYLATE;3-ethyl-5-methyl-4-(2-chlorophenyl)-6-methyl-2-[[2-[[2-(methylcarbamoyl)benzoyl]amino]ethoxy]methyl]-1,4-dihydropyridine-3,5-dicarboxylate;3-ethyl5-Methyl4-(2-chlorophenyl)-6-Methyl-2-((2-(2-(MethylcarbaMoyl)benzaMido)ethoxy)Methyl)-1,4-dihydropyridine-3,5-dicarboxylate;5-Ethyl 3-methyl 4-(2-chlorophenyl)-1,4-dihydro-2-methyl-6-[[2-[[2-[(methylamino)carbonyl]benzoyl]amino]ethoxy]methyl]-3,5-pyridinedicarboxylate;Amlodipine Imp. B (EP): 3-Ethyl 5-Methyl (4RS)-4-(2-Chlorophenyl)-6-methyl-2-[[2-[[2-(methylcarbamoyl)benzoyl]amino]-ethoxy]methyl]-1,4-dihydropyridine-3,5-dicarboxylate;3-Ethyl 5-methyl 4-(2-chlorophenyl)-6-methyl-2-[[2- [[2-(methylcarbamoyl)benzoyl]amino]ethoxy]methyl]-1,4- dihydropyridine-3,5-dicarboxylate;4-(2-Chlorophenyl)-1,4-dihydro-2-methyl-6-[[2-[[2-[(methylamino)carbonyl]benzoyl]amino]ethoxy]methyl]-5-pyridinedicarboxylic Acid 5-Ethyl 3-Methyl Ester

Chemical Property of N-(2-((Methylamino)carbonyl)benzoyl) amlodipine

Chemical Property:

• Boiling Point: 756.8±60.0 °C(Predicted)
• PKA: 13.70±0.46(Predicted)
• PSA: 139.04000
• Density: 1.254±0.06 g/cm3(Predicted)
• LogP: 4.57560
• Storage Temp.: -20°C Freezer
• Solubility.: Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly)
• XLogP3: 4.2
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 13
• Exact Mass: 569.1928781
• Heavy Atom Count: 40
• Complexity: 1010

Purity/Quality:

99% ^*data from raw suppliers

N-[2-[(Methylamino)carbonyl]benzoyl]Amlodipine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1=C(NC(=C(C1C2=CC=CC=C2Cl)C(=O)OC)C)COCCNC(=O)C3=CC=CC=C3C(=O)NC
• Uses: Amlodipine Besilate (A633500) impurity. Amlodipine EP Impurity B

Technology Process of N-(2-((Methylamino)carbonyl)benzoyl) amlodipine

There total 1 articles about N-(2-((Methylamino)carbonyl)benzoyl) amlodipine which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 92.0%

4-(2-chlorophenyl)-3-ethoxycarbonyl-5-methoxycarbonyl-6-methyl-2-[2-phthalimidoethoxymethyl]-1,4-dihydropyridine (88150-62-3,103094-30-0) + methylamine (74-89-5) → 3-ethyl-5-methyl-(4-RS)-4-(2-chlorophenyl)-6-[[2-((2-methylcarbamoyl)benzoyl)aminoethoxy]methyl]-1,4-dihydropyridine-3,5-dicarboxylate (721958-72-1)

Guidance literature:

In tetrahydrofuran; water; at 20 ℃; for 0.5h;

upstream raw materials:

4-(2-chlorophenyl)-3-ethoxycarbonyl-5-methoxycarbonyl-6-methyl-2-[2-phthalimidoethoxymethyl]-1,4-dihydropyridine

methylamine

Refernces