Lee82xnj3T

Base Information

Chemical Name:Lee82xnj3T
CAS No.:221164-60-9
Molecular Formula:C₂₁H₁₄N₆O₉
Molecular Weight:494.377
Hs Code.:
UNII:LEE82XNJ3T
Nikkaji Number:J2.025.444K
ChEMBL ID:CHEMBL116565

Synonyms:LEE82XNJ3T;GRA293;GRA-293;UNII-LEE82XNJ3T;2-Quinoxalinecarboxylic acid, 7-(4-(((((4-carboxyphenyl)amino)carbonyl)oxy)methyl)-1H-imidazol-1-yl)-3,4-dihydro-6-nitro-3-oxo-;221164-60-9;7-(4-((((4-Carboxyphenyl)carbamoyl)oxy)methyl)-1H-imidazol-1-yl)-3-hydroxy-6-nitroquinoxaline-2-carboxylic acid;CHEMBL116565;3-Oxo-6-nitro-7-[4-(4-carboxyphenylcarbamoyloxymethyl)-1H-imidazole-1-yl]-3,4-dihydroquinoxaline-2-carboxylic acid

Suppliers and Price of Lee82xnj3T

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 Lee82xnj3T

Chemical Property:

XLogP3:1.4
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:7
Exact Mass:494.08222605
Heavy Atom Count:36
Complexity:945

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC(=CC=C1C(=O)O)NC(=O)OCC2=CN(C=N2)C3=C(C=C4C(=C3)N=C(C(=O)N4)C(=O)O)[N+](=O)[O-]

Technology Process of Lee82xnj3T

There total 10 articles about Lee82xnj3T 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:

: 221166-33-2
ethyl 3-ethoxy-7-[4-((4-ethoxycarbonylphenylamino)carbonyloxymethyl)imidazol-1-yl]-6-nitroquinoxaline-2-carboxylate

: 221164-60-9
GRA 293

Guidance literature:: Multi-step reaction with 2 steps

1: 80 percent / HCl; AcOH / 24 h / 20 °C

2: LiOH / 3 h / 20 °C

With hydrogenchloride; lithium hydroxide; acetic acid;
DOI:10.1016/j.bmc.2005.05.030

Reference yield:

: 364-78-3
2-nitro-4-fluoroaniline

: 221164-60-9
GRA 293

Guidance literature:: Multi-step reaction with 9 steps

1: 88 percent / toluene / 24 h / Heating

2: 31 percent / potassium tert-butoxide / dimethylformamide / 1.5 h / 0 °C

3: 75 percent / PBr₃ / dimethylformamide / 1.5 h / 20 °C

4: 45 percent / AcOH; HNO₃ / 2 h / 80 °C

5: 68 percent / silver(I) oxide / toluene / 2 h / 100 °C

6: 43 percent / triethylamine / acetonitrile / 16 h / Heating

7: 100 percent / benzene / 2 h / Heating

8: 80 percent / HCl; AcOH / 24 h / 20 °C

9: LiOH / 3 h / 20 °C

With hydrogenchloride; lithium hydroxide; potassium tert-butylate; nitric acid; phosphorus tribromide; acetic acid; triethylamine; silver(l) oxide; In N,N-dimethyl-formamide; toluene; acetonitrile; benzene;
DOI:10.1016/j.bmc.2005.05.030

Reference yield:

: 55496-01-0
7-fluoro-3,4-dihydro-3-oxo-2-quinoxalinecarboxylic acid,ethyl ester

: 221164-60-9
GRA 293

Guidance literature:: Multi-step reaction with 6 steps

1: 45 percent / AcOH; HNO₃ / 2 h / 80 °C

2: 68 percent / silver(I) oxide / toluene / 2 h / 100 °C

3: 43 percent / triethylamine / acetonitrile / 16 h / Heating

4: 100 percent / benzene / 2 h / Heating

5: 80 percent / HCl; AcOH / 24 h / 20 °C

6: LiOH / 3 h / 20 °C

With hydrogenchloride; lithium hydroxide; nitric acid; acetic acid; triethylamine; silver(l) oxide; In toluene; acetonitrile; benzene;
DOI:10.1016/j.bmc.2005.05.030