N-[3-[2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethylimidazo[4,5-c]pyridin-6-yl]oxyphenyl]-4-(2-morpholin-4-ylethoxy)benzamide

Base Information

Chemical Name:N-[3-[2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethylimidazo[4,5-c]pyridin-6-yl]oxyphenyl]-4-(2-morpholin-4-ylethoxy)benzamide
CAS No.:925213-63-4
Molecular Formula:C₂₉H₃₀N₈O₅
Molecular Weight:570.608
Hs Code.:
UNII:F89KMM7TE2
ChEMBL ID:CHEMBL220241
DSSTox Substance ID:DTXSID40582496
Nikkaji Number:J3.437.789H
Pharos Ligand ID:G9Y4VV8DSQ35
Wikidata:Q27077891
Mol file:925213-63-4.mol

Synonyms:GSK 269962A;GSK-269962A;GSK269962A;N-(3-((2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethyl-1H-imidazo(4,5-c)pyridin-6-yl)oxy)phenyl)-4-((2-(4-morpholinyl)ethyl)oxy)benzamide

Suppliers and Price of N-[3-[2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethylimidazo[4,5-c]pyridin-6-yl]oxyphenyl]-4-(2-morpholin-4-ylethoxy)benzamide

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 10 raw suppliers

Chemical Property of N-[3-[2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethylimidazo[4,5-c]pyridin-6-yl]oxyphenyl]-4-(2-morpholin-4-ylethoxy)benzamide

Chemical Property:

PSA：155.68000
LogP:4.43110
XLogP3:2.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:10
Exact Mass:570.23391609
Heavy Atom Count:42
Complexity:860

Purity/Quality:: 97% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCN1C2=CC(=NC=C2N=C1C3=NON=C3N)OC4=CC=CC(=C4)NC(=O)C5=CC=C(C=C5)OCCN6CCOCC6

Technology Process of N-[3-[2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethylimidazo[4,5-c]pyridin-6-yl]oxyphenyl]-4-(2-morpholin-4-ylethoxy)benzamide

There total 17 articles about N-[3-[2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethylimidazo[4,5-c]pyridin-6-yl]oxyphenyl]-4-(2-morpholin-4-ylethoxy)benzamide 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: 83.0%

: 4-[2-(morpholin-4-yl)ethoxy]benzoyl chloride

: 850663-66-0
4-{6-[(3-aminophenyl)oxy]-1-ethyl-1H-imidazo[4,5-c]pyridin-2-yl}-furazan-3-amine

: 850664-21-0,925213-63-4
GSK₂₆₉₉₆₂A

Guidance literature:: With pyridine; In dichloromethane; at 70 ℃;
DOI:10.1021/jm060873p

Reference yield:

: 5435-54-1
4-hydroxy-3-nitropyridine

: 850664-21-0,925213-63-4
GSK₂₆₉₉₆₂A

Guidance literature:: Multi-step reaction with 13 steps

1: 99 percent / POCl₃ / toluene / 16 h / 110 °C

2: 80 percent / potassium t-butoxide; t-BuOOH / tetrahydrofuran; decane; liquid ammonia / 2 h / -35 °C

3: 74 percent / POCl₃ / toluene / 6 h / Heating

4: 83 percent / tetrahydrofuran; H₂O / 1 h

5: 96 percent / K₂CO₃ / dimethylformamide / 24 h / 100 °C

6: H₂ / Pd/C / methanol; tetrahydrofuran / 6 h / 3750.3 Torr

7: Et₃N; EDCl / D₂O / 15 - 20 °C

8: acetic acid / 5 h / Heating

9: aq. HCl; sodium nitrite / methanol / 28 h / 15 - 20 °C

10: 88 percent / hydroxylamine / tetrahydrofuran / 10 h / Heating

11: 42 percent / Et₃N / dioxane / 9 h / Heating

12: 100 percent / H₂SO₄ / 2 h / 50 °C

13: 83 percent / pyridine / CH₂Cl₂ / 70 °C

With pyridine; hydrogenchloride; tert.-butylhydroperoxide; sulfuric acid; potassium tert-butylate; hydrogen; hydroxylamine; potassium carbonate; acetic acid; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; triethylamine; sodium nitrite; trichlorophosphate; palladium on activated charcoal; In tetrahydrofuran; 1,4-dioxane; methanol; decane; dichloromethane; ammonia; water; water-d2; N,N-dimethyl-formamide; toluene;
DOI:10.1021/jm060873p

Reference yield:

: 607373-89-7
2-chloro-N-ethyl-5-nitro-4-pyridinamine

: 850664-21-0,925213-63-4
GSK₂₆₉₉₆₂A

Guidance literature:: Multi-step reaction with 9 steps

1: 96 percent / K₂CO₃ / dimethylformamide / 24 h / 100 °C

2: H₂ / Pd/C / methanol; tetrahydrofuran / 6 h / 3750.3 Torr

3: Et₃N; EDCl / D₂O / 15 - 20 °C

4: acetic acid / 5 h / Heating

5: aq. HCl; sodium nitrite / methanol / 28 h / 15 - 20 °C

6: 88 percent / hydroxylamine / tetrahydrofuran / 10 h / Heating

7: 42 percent / Et₃N / dioxane / 9 h / Heating

8: 100 percent / H₂SO₄ / 2 h / 50 °C

9: 83 percent / pyridine / CH₂Cl₂ / 70 °C

With pyridine; hydrogenchloride; sulfuric acid; hydrogen; hydroxylamine; potassium carbonate; acetic acid; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; triethylamine; sodium nitrite; palladium on activated charcoal; In tetrahydrofuran; 1,4-dioxane; methanol; dichloromethane; water-d2; N,N-dimethyl-formamide;
DOI:10.1021/jm060873p