3-(4-((1-(3-Ethoxyphenyl)-2-(4-methylphenyl)-1H-imidazol-4-yl)carbonyl)piperazin-1-yl)naphthalene-1-carboxylic acid

Base Information

Chemical Name:3-(4-((1-(3-Ethoxyphenyl)-2-(4-methylphenyl)-1H-imidazol-4-yl)carbonyl)piperazin-1-yl)naphthalene-1-carboxylic acid
CAS No.:954397-95-6
Molecular Formula:C₃₄H₃₂N₄O₄
Molecular Weight:560.652
Hs Code.:
UNII:U7DR3EKC3L
ChEMBL ID:CHEMBL505727
DSSTox Substance ID:DTXSID6047731
Pharos Ligand ID:8PWX49S25T1H
Wikidata:Q81976467
Mol file:954397-95-6.mol

Synonyms:954397-95-6;U7DR3EKC3L;UNII-U7DR3EKC3L;CHEMBL505727;1-Naphthalenecarboxylic acid, 3-[4-[[1-(3-ethoxyphenyl)-2-(4-methylphenyl)-1H-imidazol-4-yl]carbonyl]-1-piperazinyl]-;3-(4-((1-(3-Ethoxyphenyl)-2-(4-methylphenyl)-1H-imidazol-4-yl)carbonyl)piperazin-1-yl)naphthalene-1-carboxylic acid;1-Naphthalenecarboxylic acid, 3-(4-((1-(3-ethoxyphenyl)-2-(4-methylphenyl)-1H-imidazol-4-yl)carbonyl)-1-piperazinyl)-;3-(4-((1-(3-Ethoxyphenyl)-2-(4-methylphenyl)-1H-imidazol-4-yl)carbonyl)-1-piperazinyl)-1-naphthoic acid;3-(4-{[1-(3-Ethoxyphenyl)-2-(4-methylphenyl)-1H-imidazol-4-yl]carbonyl}piperazin-1-yl)naphthalene-1-carboxylic acid;3-[4-[[1-(3-Ethoxyphenyl)-2-(4-methylphenyl)-1H-imidazol-4-yl]carbonyl]-1-piperazinyl]-1-naphthoic acid;1-Naphthalenecarboxylic acid,3-[4-[[1-(3-ethoxyphenyl)-2-(4-methylphenyl)-1H-imidazol-4-yl]carbonyl]-1-piperazinyl]-;SCHEMBL502146;DTXSID6047731;BDBM50245180;PD119672;NS00015688;3-(4-(1-(3-Ethoxyphenyl)-2-(p-tolyl)-1H-imidazole-4-carbonyl)piperazin-1-yl)-1-naphthoic acid;3-(4-(1-(3-ethoxyphenyl)-2-p-tolyl-1H-imidazole-4-carbonyl)piperazin-1-yl)-1-naphthoic acid;3-[4-[1-(3-ethoxyphenyl)-2-(4-methylphenyl)imidazole-4-carbonyl]piperazin-1-yl]naphthalene-1-carboxylic acid

Suppliers and Price of 3-(4-((1-(3-Ethoxyphenyl)-2-(4-methylphenyl)-1H-imidazol-4-yl)carbonyl)piperazin-1-yl)naphthalene-1-carboxylic acid

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
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price

Total 3 raw suppliers

Chemical Property of 3-(4-((1-(3-Ethoxyphenyl)-2-(4-methylphenyl)-1H-imidazol-4-yl)carbonyl)piperazin-1-yl)naphthalene-1-carboxylic acid

Chemical Property:

XLogP3:6.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:560.24235551
Heavy Atom Count:42
Complexity:917

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC1=CC=CC(=C1)N2C=C(N=C2C3=CC=C(C=C3)C)C(=O)N4CCN(CC4)C5=CC6=CC=CC=C6C(=C5)C(=O)O

Technology Process of 3-(4-((1-(3-Ethoxyphenyl)-2-(4-methylphenyl)-1H-imidazol-4-yl)carbonyl)piperazin-1-yl)naphthalene-1-carboxylic acid

There total 8 articles about 3-(4-((1-(3-Ethoxyphenyl)-2-(4-methylphenyl)-1H-imidazol-4-yl)carbonyl)piperazin-1-yl)naphthalene-1-carboxylic acid 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:

: 954397-98-9
methyl 3-(4-{[1-(3-ethoxyphenyl)-2-(4-methylphenyl)-1H-imidazol-4-yl]carbonyl}-1-piperazinyl)-1-naphthoate

: 954397-95-6
3-{4-[1-(3-ethoxyphenyl)-2-p-tolyl-1H-imidazole-4-carbonyl]piperazin-1-yl}naphthalene-1-carboxylic acid

Guidance literature:: methyl 3-(4-{[1-(3-ethoxyphenyl)-2-(4-methylphenyl)-1H-imidazol-4-yl]carbonyl}-1-piperazinyl)-1-naphthoate; With sodium hydroxide; In N,N-dimethyl acetamide; at 50 ℃; for 4h;

With phosphoric acid; In N,N-dimethyl acetamide; water; at 20 ℃; pH=Ca. 5;
DOI:10.1021/op800176e

Reference yield:

: 954382-61-7
ethyl 1-(3-ethoxyphenyl)-2-(4-methylphenyl)-1H-imidazole-4-carboxylate

: 954397-95-6
3-{4-[1-(3-ethoxyphenyl)-2-p-tolyl-1H-imidazole-4-carbonyl]piperazin-1-yl}naphthalene-1-carboxylic acid

Guidance literature:: Multi-step reaction with 4 steps

1.1: sodium hydroxide / tetrahydrofuran; methanol; water / 20 °C

1.2: pH Ca_. 3 - 3.5

2.1: N,N-dimethyl acetamide / 1 h / 20 °C

3.1: N,N-dimethyl acetamide / 6 h / 50 °C

4.1: sodium hydroxide / N,N-dimethyl acetamide / 4 h / 50 °C

4.2: 20 °C / pH Ca_. 5

With sodium hydroxide; In tetrahydrofuran; methanol; N,N-dimethyl acetamide; water;
DOI:10.1021/op800176e

Reference yield:

: 104-85-8
para-methylbenzonitrile

: 954397-95-6
3-{4-[1-(3-ethoxyphenyl)-2-p-tolyl-1H-imidazole-4-carbonyl]piperazin-1-yl}naphthalene-1-carboxylic acid

Guidance literature:: Multi-step reaction with 6 steps

1.1: sodium hexamethyldisilazane / tetrahydrofuran / 0.67 h / 0 - 8 °C

1.2: 1.33 h / 3 - 20 °C

2.1: sodium hydrogencarbonate / 1,4-dioxane / 2 h / 95 - 97 °C

3.1: sodium hydroxide / tetrahydrofuran; methanol; water / 20 °C

3.2: pH Ca_. 3 - 3.5

4.1: N,N-dimethyl acetamide / 1 h / 20 °C

5.1: N,N-dimethyl acetamide / 6 h / 50 °C

6.1: sodium hydroxide / N,N-dimethyl acetamide / 4 h / 50 °C

6.2: 20 °C / pH Ca_. 5

With sodium hexamethyldisilazane; sodium hydrogencarbonate; sodium hydroxide; In tetrahydrofuran; 1,4-dioxane; methanol; N,N-dimethyl acetamide; water;
DOI:10.1021/op800176e