1H-Indole-2-carboxylic acid, 5-[(2-benzofuranylcarbonyl)amino]-

Base Information

Chemical Name:1H-Indole-2-carboxylic acid, 5-[(2-benzofuranylcarbonyl)amino]-
CAS No.:110314-42-6
Molecular Formula:C18H12N2O4
Molecular Weight:320.304
Hs Code.:2934999090
DSSTox Substance ID:DTXSID00438364
Nikkaji Number:J2.718.948B
Wikidata:Q82254085
Mol file:110314-42-6.mol

Synonyms:110314-42-6;1H-Indole-2-carboxylic acid, 5-[(2-benzofuranylcarbonyl)amino]-;5-(1-benzofuran-2-carbonylamino)-1H-indole-2-carboxylic acid;SCHEMBL5733671;DTXSID00438364;BYSRZPAQWYCFMD-UHFFFAOYSA-N;5-[(1-Benzofuran-2-carbonyl)amino]-1H-indole-2-carboxylic acid;5-[(Benzofuran-2-yl)carbonylamino]-1H-indole-2-carboxylic acid

Suppliers and Price of 1H-Indole-2-carboxylic acid, 5-[(2-benzofuranylcarbonyl)amino]-

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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Total 1 raw suppliers

Chemical Property of 1H-Indole-2-carboxylic acid, 5-[(2-benzofuranylcarbonyl)amino]-

Chemical Property:

PSA：95.33000
LogP:3.93760
XLogP3:3.5
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:320.07970687
Heavy Atom Count:24
Complexity:511

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C2C(=C1)C=C(O2)C(=O)NC3=CC4=C(C=C3)NC(=C4)C(=O)O

Technology Process of 1H-Indole-2-carboxylic acid, 5-[(2-benzofuranylcarbonyl)amino]-

There total 5 articles about 1H-Indole-2-carboxylic acid, 5-[(2-benzofuranylcarbonyl)amino]- 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: 80.0%

: 112089-69-7
ethyl 5-<(1H-benzofuran-2-ylcarbonyl)amino>-1H-indole-2-carboxylate

: 110314-42-6
5-<(1H-benzofuran-2-ylcarbonyl)amino>-1H-indole-2-carboxylic acid

Guidance literature:: With sodium hydroxide; In pyridine; for 48h;
DOI:10.1021/jm00398a017

Reference yield:

: 4993-93-5
4-nitro-1H-indole-2-carboxylic acid ethyl ester

: 110314-42-6
5-<(1H-benzofuran-2-ylcarbonyl)amino>-1H-indole-2-carboxylic acid

Guidance literature:: Multi-step reaction with 3 steps

1: 83 percent / hydrogen / PtO₂ / ethanol; tetrahydrofuran / 3.25 h / 724.01 Torr

2: 90 percent / 1-ethyl-3-<3-(dimethylamino)propyl>carbodiimide hydrochloride / dimethylformamide / 48 h

3: 80 percent / aq. NaOH / pyridine / 48 h

With sodium hydroxide; hydrogen; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; platinum(IV) oxide; In tetrahydrofuran; pyridine; ethanol; N,N-dimethyl-formamide;
DOI:10.1021/jm00398a017

Reference yield:

: 496-41-3
Benzofuran-2-carboxylic acid

: 110314-42-6
5-<(1H-benzofuran-2-ylcarbonyl)amino>-1H-indole-2-carboxylic acid

Guidance literature:: Multi-step reaction with 2 steps

1: 90 percent / 1-ethyl-3-<3-(dimethylamino)propyl>carbodiimide hydrochloride / dimethylformamide / 48 h

2: 80 percent / aq. NaOH / pyridine / 48 h

With sodium hydroxide; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; In pyridine; N,N-dimethyl-formamide;
DOI:10.1021/jm00398a017