1-{3-[(1,3-Benzothiazol-2-yl)methoxy]phenyl}pyrrolidine-2,5-dione

Base Information

Chemical Name:1-{3-[(1,3-Benzothiazol-2-yl)methoxy]phenyl}pyrrolidine-2,5-dione
CAS No.:101133-68-0
Molecular Formula:C18H14N2O3S
Molecular Weight:338.387
Hs Code.:
ChEMBL ID:CHEMBL131069
DSSTox Substance ID:DTXSID70542104
Wikidata:Q82418640
Mol file:101133-68-0.mol

Synonyms:101133-68-0;CHEMBL131069;SCHEMBL11013252;DTXSID70542104;XIGJVCFAJHGXOL-UHFFFAOYSA-N;1-{3-[(1,3-Benzothiazol-2-yl)methoxy]phenyl}pyrrolidine-2,5-dione;N-[3-[(2-benzothiazolyl)methoxy]phenyl]pyrrolidin-2,5-dione

Suppliers and Price of 1-{3-[(1,3-Benzothiazol-2-yl)methoxy]phenyl}pyrrolidine-2,5-dione

Supply Marketing:

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

Manufacturers and distributors:

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Chemical Property of 1-{3-[(1,3-Benzothiazol-2-yl)methoxy]phenyl}pyrrolidine-2,5-dione

Chemical Property:

XLogP3:2.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:338.07251349
Heavy Atom Count:24
Complexity:485

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CC(=O)N(C1=O)C2=CC(=CC=C2)OCC3=NC4=CC=CC=C4S3

Technology Process of 1-{3-[(1,3-Benzothiazol-2-yl)methoxy]phenyl}pyrrolidine-2,5-dione

There total 3 articles about 1-{3-[(1,3-Benzothiazol-2-yl)methoxy]phenyl}pyrrolidine-2,5-dione 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: 56.0%

: 37859-43-1
2-chloromethylbenzothiazole

: 101133-70-4
4-<(3-hydroxyphenyl)amino>-4-oxobutanoic acid methyl ester

: 101133-68-0
N-[3-[(2-benzothiazolyl)methoxy]phenyl]pyrrolidin-2,5-dione

Guidance literature:: With sodium carbonate; caesium carbonate; potassium iodide; In acetone; for 2h; Heating;
DOI:10.1021/jm00385a024

Reference yield:

: 137-07-5
2-amino-benzenethiol

: 101133-68-0
N-[3-[(2-benzothiazolyl)methoxy]phenyl]pyrrolidin-2,5-dione

Guidance literature:: Multi-step reaction with 2 steps

1: 71 percent / CH₂Cl₂ / Ambient temperature

2: 56 percent / cesium carbonate, sodium carbonate, potassium iodide / acetone / 2 h / Heating

With sodium carbonate; caesium carbonate; potassium iodide; In dichloromethane; acetone;
DOI:10.1021/jm00385a024

Reference yield:

: 591-27-5
m-Hydroxyaniline

: 101133-68-0
N-[3-[(2-benzothiazolyl)methoxy]phenyl]pyrrolidin-2,5-dione

Guidance literature:: Multi-step reaction with 2 steps

1: 88 percent / triethylamine / tetrahydrofuran

2: 56 percent / cesium carbonate, sodium carbonate, potassium iodide / acetone / 2 h / Heating

With sodium carbonate; caesium carbonate; triethylamine; potassium iodide; In tetrahydrofuran; acetone;
DOI:10.1021/jm00385a024