3-Imidazo[2,1-b][1,3]thiazol-6-ylaniline

Base Information

• Chemical Name: 3-Imidazo[2,1-b][1,3]thiazol-6-ylaniline
• CAS No.: 861206-26-0
• Molecular Formula: C₁₁H₉N₃S
• Molecular Weight: 215.279
• Hs Code.: 2934100090
• DSSTox Substance ID: DTXSID90391358
• Wikidata: Q82188770
• ChEMBL ID: CHEMBL1314398
• Mol file: 861206-26-0.mol

Synonyms:861206-26-0;3-imidazo[2,1-b][1,3]thiazol-6-ylaniline;3-Imidazo[2,1-b]thiazol-6-yl-phenylamine;(3-Imidazo[2,1-b][1,3]thiazol-6-ylphenyl)amine;3-(Imidazo[2,1-b][1,3]thiazol-6-yl)aniline;3-{imidazo[2,1-b][1,3]thiazol-6-yl}aniline;3-(imidazo[2,1-b]thiazol-6-yl)aniline;CHEMBL1314398;DTXSID90391358;HMS1901E10;HMS3523M03;CCG-96870;MFCD03617826;AKOS000302213;NCGC00135534-01;CS-0060406;EN300-76893;S12158;1W-0877;BRD-K38422024-001-02-5;G856-0531;F1959-0001;Z414834392

Chemical Property of 3-Imidazo[2,1-b][1,3]thiazol-6-ylaniline

Chemical Property:

• PKA: 6.08±0.40(Predicted)
• Density: 1.42±0.1 g/cm3(Predicted)
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 215.05171847
• Heavy Atom Count: 15
• Complexity: 236

Purity/Quality:

98%,99%, ^*data from raw suppliers

3-imidazo[2,1-b][1,3]thiazol-6-ylaniline ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC(=CC(=C1)N)C2=CN3C=CSC3=N2

Technology Process of 3-Imidazo[2,1-b][1,3]thiazol-6-ylaniline

There total 1 articles about 3-Imidazo[2,1-b][1,3]thiazol-6-ylaniline 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:

6-(3-nitrophenyl)imidazo[2,1-b]thiazole → 3-(imidazo[2,1-b]thiazol-6-yl)aniline (861206-26-0)

Guidance literature:

6-(3-nitrophenyl)imidazo[2,1-b]thiazole; With hydrogenchloride; tin(ll) chloride; In 1-methyl-pyrrolidin-2-one; water; at 85 ℃; for 0.166667h;

With sodium hydroxide; In 1-methyl-pyrrolidin-2-one; water; at 20 ℃;

Reference yield:

3-(imidazo[2,1-b]thiazol-6-yl)aniline (861206-26-0) + benzoyl chloride (98-88-4) → C18H13N3OS (670248-07-4)

Guidance literature:

3-(imidazo[2,1-b]thiazol-6-yl)aniline; benzoyl chloride; In 1-methyl-pyrrolidin-2-one; for 0.5h;

In 1-methyl-pyrrolidin-2-one; for 10h;

With triethylamine; In 1-methyl-pyrrolidin-2-one;

Reference yield:

3-(imidazo[2,1-b]thiazol-6-yl)aniline (861206-26-0) + (3,4,5-trimethoxy)benzoyl isothiocyanate (6939-63-5) → N-(N-(3-(imidazo[2,1-b]thiazol-6-yl)phenyl)carbamimidoyl)-3,4,5-trimethoxybenzamide (1263131-96-9)

Guidance literature:

Multi-step reaction with 2 steps

1: acetone / 1 h / Inert atmosphere; Reflux

2: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 1,1,1,3,3,3-hexamethyl-disilazane / acetonitrile / 5 h / 20 °C / Inert atmosphere; Cooling with ice

With 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 1,1,1,3,3,3-hexamethyl-disilazane; In acetone; acetonitrile;

DOI:10.1021/jm2013369

Downstream raw materials:

C₁₈H₁₃N₃OS

N-(3-(imidazo[2,1-b]thiazol-6-yl)phenylcarbamothioyl)-3,4,5-trimethoxybenzamide

N-(N-(3-(imidazo[2,1-b]thiazol-6-yl)phenyl)carbamimidoyl)-3,4,5-trimethoxybenzamide