3-O-ethyl 5-O-methyl 2-[2-(2-amino-5-oxo-4H-imidazol-3-yl)ethoxymethyl]-4-(2,3-dichlorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate

Base Information

Chemical Name:3-O-ethyl 5-O-methyl 2-[2-(2-amino-5-oxo-4H-imidazol-3-yl)ethoxymethyl]-4-(2,3-dichlorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate
CAS No.:97290-20-5
Molecular Formula:C23H26 Cl2 N4 O6
Molecular Weight:525.3817
Hs Code.:
DSSTox Substance ID:DTXSID40914016
Nikkaji Number:J322.353A
ChEMBL ID:CHEMBL52952

3-O-ethyl 5-O-methyl 2-[2-(2-amino-5-oxo-4H-imidazol-3-yl)ethoxymethyl]-4-(2,3-dichlorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate

Synonyms:2-amino-1-(2-((4-(2,3-dichlorophenyl)-3-(ethoxycarbonyl)-5-(methoxycarbonyl)-6-methyl-1,4-dihydropyrid-2-yl)methoxy)ethyl)-4(5H)imidazolone hemihydrate;UK 55444;UK-55444

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Chemical Property of 3-O-ethyl 5-O-methyl 2-[2-(2-amino-5-oxo-4H-imidazol-3-yl)ethoxymethyl]-4-(2,3-dichlorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate

Chemical Property:

Vapor Pressure:3.42E-16mmHg at 25°C
Boiling Point:638.3°Cat760mmHg
Flash Point:339.8°C
PSA：132.55000
Density:1.45g/cm³
LogP:2.52050
XLogP3:1.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:11
Exact Mass:524.1229399
Heavy Atom Count:35
Complexity:950

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCOC(=O)C1=C(NC(=C(C1C2=C(C(=CC=C2)Cl)Cl)C(=O)OC)C)COCCN3CC(=O)N=C3N

Technology Process of 3-O-ethyl 5-O-methyl 2-[2-(2-amino-5-oxo-4H-imidazol-3-yl)ethoxymethyl]-4-(2,3-dichlorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate

There total 3 articles about 3-O-ethyl 5-O-methyl 2-[2-(2-amino-5-oxo-4H-imidazol-3-yl)ethoxymethyl]-4-(2,3-dichlorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate 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: 69.0%

: 97290-19-2
ethyl 2-methoxy>ethyl>-N-cyanoamino>acetate

: 97290-20-5
2-[2-(2-Amino-4-oxo-4,5-dihydro-imidazol-1-yl)-ethoxymethyl]-4-(2,3-dichloro-phenyl)-6-methyl-1,4-dihydro-pyridine-3,5-dicarboxylic acid 3-ethyl ester 5-methyl ester

Guidance literature:: With ammonium hydroxide; In methanol; for 16h; Ambient temperature;
DOI:10.1021/jm00168a041

Reference yield:

: 88150-50-9
2-[(2-aminoethoxy)methyl]-4-(2,3-dichlorophenyl)-3-ethoxycarbonyl-5-methoxycarbonyl-6-methyl-1,4-dihydropyridine

: 97290-20-5
2-[2-(2-Amino-4-oxo-4,5-dihydro-imidazol-1-yl)-ethoxymethyl]-4-(2,3-dichloro-phenyl)-6-methyl-1,4-dihydro-pyridine-3,5-dicarboxylic acid 3-ethyl ester 5-methyl ester

Guidance literature:: Multi-step reaction with 3 steps

1: 57 percent / K₂CO₃ / acetonitrile / 3.5 h / Heating

2: 62 percent / NaHCO₃ / CHCl₃ / 7.5 h / Ambient temperature

3: 69 percent / conc. aq. NH₃ / methanol / 16 h / Ambient temperature

With ammonium hydroxide; sodium hydrogencarbonate; potassium carbonate; In methanol; chloroform; acetonitrile;
DOI:10.1021/jm00168a041

Reference yield:

: 97289-98-0
ethyl 2-<<2-<<4-(2,3-dichlorophenyl)-3-(ethoxycarbonyl)-5-(methoxycarbonyl)-6-methyl-1,4-dihydropyrid-2-yl>methoxy>ethyl>amino>acetate

: 97290-20-5
2-[2-(2-Amino-4-oxo-4,5-dihydro-imidazol-1-yl)-ethoxymethyl]-4-(2,3-dichloro-phenyl)-6-methyl-1,4-dihydro-pyridine-3,5-dicarboxylic acid 3-ethyl ester 5-methyl ester

Guidance literature:: Multi-step reaction with 2 steps

1: 62 percent / NaHCO₃ / CHCl₃ / 7.5 h / Ambient temperature

2: 69 percent / conc. aq. NH₃ / methanol / 16 h / Ambient temperature

With ammonium hydroxide; sodium hydrogencarbonate; In methanol; chloroform;
DOI:10.1021/jm00168a041