Benzoic acid, 4-[2-[4-(2-methoxyethyl)-1-piperazinyl]-4-thiazolyl]-

Base Information

Chemical Name:Benzoic acid, 4-[2-[4-(2-methoxyethyl)-1-piperazinyl]-4-thiazolyl]-
CAS No.:860343-99-3
Molecular Formula:C17H21N3O3S
Molecular Weight:347.438
Hs Code.:
DSSTox Substance ID:DTXSID30470095
Wikidata:Q82298076

Synonyms:860343-99-3;Benzoic acid, 4-[2-[4-(2-methoxyethyl)-1-piperazinyl]-4-thiazolyl]-;SCHEMBL1473968;DTXSID30470095;AECPLWYYFCBDJC-UHFFFAOYSA-N;4-{2-[4-(2-Methoxy-ethyl)-piperazin-1-yl]-thiazol-4-yl}-benzoic acid;4-{2-[4-(2-Methoxy-ethyl)-piperazin-1-yl]thiazol-4-yl}-benzoic acid

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Supply Marketing:

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

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Chemical Property of Benzoic acid, 4-[2-[4-(2-methoxyethyl)-1-piperazinyl]-4-thiazolyl]-

Chemical Property:

XLogP3:0
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:347.13036271
Heavy Atom Count:24
Complexity:410

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COCCN1CCN(CC1)C2=NC(=CS2)C3=CC=C(C=C3)C(=O)O

Technology Process of Benzoic acid, 4-[2-[4-(2-methoxyethyl)-1-piperazinyl]-4-thiazolyl]-

There total 4 articles about Benzoic acid, 4-[2-[4-(2-methoxyethyl)-1-piperazinyl]-4-thiazolyl]- 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:

: 920009-73-0
4-(2-piperazin-1-yl-thiazol-4-yl)-benzoic acid

: 24332-20-5
methoxyacetaldehyde dimethylacetal

: 860343-99-3
4-{2-[4-(2-methoxy-ethyl)-piperazin-1-yl]-thiazol-4-yl}-benzoic acid

Guidance literature:: methoxyacetaldehyde dimethylacetal; With hydrogenchloride; In water; at 50 ℃; for 1.5h;

4-(2-piperazin-1-yl-thiazol-4-yl)-benzoic acid; With sodium acetate; acetic acid; In water; acetonitrile; at 20 ℃; for 1.5h; pH=5.5;

With sodium cyanoborohydride; In water; acetonitrile; at 20 ℃; for 16h;

Reference yield:

: 586-89-0
4-acetyl-benzoic acid

: 860343-99-3
4-{2-[4-(2-methoxy-ethyl)-piperazin-1-yl]-thiazol-4-yl}-benzoic acid

Guidance literature:: Multi-step reaction with 2 steps

1: 67 percent / Br₂; AcOH / 1 h / 80 °C

2: tetrahydrofuran / 3 h / Heating

With bromine; acetic acid; In tetrahydrofuran;
DOI:10.1021/jm058198r

Reference yield:

: 13484-40-7
1-(2-methoxyethyl)piperazine

: 860343-99-3
4-{2-[4-(2-methoxy-ethyl)-piperazin-1-yl]-thiazol-4-yl}-benzoic acid

Guidance literature:: Multi-step reaction with 2 steps

1.1: tetrahydrofuran / 2 h / 20 - 55 °C

1.2: NH₃ / ethanol; tetrahydrofuran / 20 - 55 °C

2.1: tetrahydrofuran / 3 h / Heating

In tetrahydrofuran;
DOI:10.1021/jm058198r