Ethyl 4,5,6,7-tetrahydrothiazolo[5,4-c]pyridine-2-carboxylate hydrochloride

Base Information

• Chemical Name: Ethyl 4,5,6,7-tetrahydrothiazolo[5,4-c]pyridine-2-carboxylate hydrochloride
• CAS No.: 1186663-33-1
• Molecular Formula: C₉H₁₂N₂O₂S*ClH
• Molecular Weight: 248.733
• Hs Code.: 2934999090
• DSSTox Substance ID: DTXSID50693906
• Mol file: 1186663-33-1.mol

Synonyms:1186663-33-1;ethyl 4,5,6,7-tetrahydrothiazolo[5,4-c]pyridine-2-carboxylate hydrochloride;MFCD12828696;Ethyl 4,5,6,7-Tetrahydrothiazolo[5,4-c]-pyridine-2-carboxylate hydrochloride;4,5,6,7-Tetrahydro-thiazolo[5,4-c]pyridine-2-carboxylic acid ethyl ester hydrochloride;ethyl 4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine-2-carboxylate;hydrochloride;Ethyl 4,5,6,7-Tetrahydrothiazolo[5,4-c]pyridine-2-carboxylate HCl;Ethyl 4,5,6,7-tetrahydrothiazolo[5,4-c]pyridine-2-carboxylate, HCl;SCHEMBL978519;DTXSID50693906;AMY20489;BCP20424;AKOS015904149;Ethyl4,5,6,7-Tetrahydrothiazolo[5,4-c]pyridine-2-carboxylateHydrochloride;SB31085;AC-29521;DS-16896;SY006157;CS-0041463;FT-0766265;A893041;Ethyl 4,5,6,7-tetrahydro[1,3]thiazolo[5,4-c]pyridine-2-carboxylate--hydrogen chloride (1/1)

Chemical Property of Ethyl 4,5,6,7-tetrahydrothiazolo[5,4-c]pyridine-2-carboxylate hydrochloride

Chemical Property:

• PSA: 79.46000
• LogP: 2.09630
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 248.0386265
• Heavy Atom Count: 15
• Complexity: 225

Purity/Quality:

97% ^*data from raw suppliers

Ethyl4,5,6,7-Tetrahydrothiazolo[5,4-c]pyridine-2-carboxylateHydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1=NC2=C(S1)CNCC2.Cl
• Uses: Ethyl 4,5,6,7-tetrahydrothiazolo[5,4-c]pyridine-2-carboxylate, HCl

Technology Process of Ethyl 4,5,6,7-tetrahydrothiazolo[5,4-c]pyridine-2-carboxylate hydrochloride

There total 1 articles about Ethyl 4,5,6,7-tetrahydrothiazolo[5,4-c]pyridine-2-carboxylate hydrochloride 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:

5-tert-butyl 2-ethyl 6,7-dihydro[1,3]thiazolo[5,4-c]pyridine-2,5(4H)-dicarboxylate (1053656-51-1) → C9H12N2O2S*ClH (1186663-33-1)

Guidance literature:

With hydrogenchloride; In 1,4-dioxane; at 20 ℃; for 1h;

Reference yield:

C9H12N2O2S*ClH (1186663-33-1) → 4-(2-(5-carbamimidoyl-4,5,6,7-tetrahydrothiazolo[5,4-c]pyridine-2-carbonyl)-5-(4-methoxypiperidin-1-yl)-1 ,2,3,4-tetrahydroisoquinoline-1-carboxamido)benzoic acid trifluoroacetate (1598386-43-6)

Guidance literature:

Multi-step reaction with 3 steps

1.1: N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 14 h

2.1: lithium hydroxide monohydrate; water / tetrahydrofuran; methanol / 14 h / 50 °C

3.1: methanol / 50 °C

3.2: 2 h

With lithium hydroxide monohydrate; water; N-ethyl-N,N-diisopropylamine; In tetrahydrofuran; methanol; N,N-dimethyl-formamide;

Reference yield:

C9H12N2O2S*ClH (1186663-33-1) → 4-(5-bromo-2-(5-carbamimidoyl-4,5,6,7-tetrahydrothiazolo[5,4-c]pyridine-2-carbonyl)-1,2,3,4-tetrahydroisoquinoline-1-carboxamido)benzoic acid trifluoroacetate

Guidance literature:

Multi-step reaction with 3 steps

1.1: N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 14 h

2.1: lithium hydroxide monohydrate; water / tetrahydrofuran; methanol / 14 h / 50 °C

3.1: N-ethyl-N,N-diisopropylamine; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; benzotriazol-1-ol / N,N-dimethyl-formamide / 20 h

3.2: 1 h

With lithium hydroxide monohydrate; water; benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; N-ethyl-N,N-diisopropylamine; In tetrahydrofuran; methanol; N,N-dimethyl-formamide;

upstream raw materials:

5-tert-butyl 2-ethyl 6,7-dihydro[1,3]thiazolo[5,4-c]pyridine-2,5(4H)-dicarboxylate

Downstream raw materials:

4-(2-(5-carbamimidoyl-4,5,6,7-tetrahydrothiazolo[5,4-c]pyridine-2-carbonyl)-5-(4-methoxypiperidin-1-yl)-1 ,2,3,4-tetrahydroisoquinoline-1-carboxamido)benzoic acid trifluoroacetate