Ethyl 2-[2-(2-benzamidoethyl)-1,3-thiazol-4-yl]-1,3-thiazole-4-carboxylate

Base Information

• Chemical Name: Ethyl 2-[2-(2-benzamidoethyl)-1,3-thiazol-4-yl]-1,3-thiazole-4-carboxylate
• CAS No.: 30760-79-3
• Molecular Formula: C₁₈H₁₇N₃O₃S₂
• Molecular Weight: 387.483
• NSC Number: 143140
• DSSTox Substance ID: DTXSID40301407
• Wikidata: Q82045312
• ChEMBL ID: CHEMBL2086880
• Mol file: 30760-79-3.mol

Synonyms:30760-79-3;MLS002920582;Ethyl 2'-(2-benzamidoethyl)-[2,4'-bithiazole]-4-carboxylate;NSC143140;ethyl 2-[2-(2-benzamidoethyl)-1,3-thiazol-4-yl]-1,3-thiazole-4-carboxylate;CHEMBL2086880;DTXSID40301407;NSC-143140;SMR001798170;Ethyl2'-(2-benzamidoethyl)-[2,4'-bithiazole]-4-carboxylate

Chemical Property of Ethyl 2-[2-(2-benzamidoethyl)-1,3-thiazol-4-yl]-1,3-thiazole-4-carboxylate

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: 1.326g/cm³
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 8
• Exact Mass: 387.07113376
• Heavy Atom Count: 26
• Complexity: 488

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1=CSC(=N1)C2=CSC(=N2)CCNC(=O)C3=CC=CC=C3

Technology Process of Ethyl 2-[2-(2-benzamidoethyl)-1,3-thiazol-4-yl]-1,3-thiazole-4-carboxylate

There total 5 articles about Ethyl 2-[2-(2-benzamidoethyl)-1,3-thiazol-4-yl]-1,3-thiazole-4-carboxylate 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:

β-benzamidothiopropionamide (30761-30-9) → NCI 0143140 (30760-79-3)

Guidance literature:

Multi-step reaction with 5 steps

2: NH₃ / methanol

3: POCl₃ / pyridine

4: H₂S

With hydrogen sulfide; ammonia; trichlorophosphate; In pyridine; methanol;

Reference yield:

2-(2-benzoylamino-ethyl)-thiazole-4-carboxylic acid amide (30761-32-1) → NCI 0143140 (30760-79-3)

Guidance literature:

Multi-step reaction with 3 steps

1: POCl₃ / pyridine

2: H₂S

With hydrogen sulfide; trichlorophosphate; In pyridine;

Reference yield:

ethyl 2-<(N-benzoylamino)ethyl>thiazole-4-carboxylate (30761-31-0) → NCI 0143140 (30760-79-3)

Guidance literature:

Multi-step reaction with 4 steps

1: NH₃ / methanol

2: POCl₃ / pyridine

3: H₂S

With hydrogen sulfide; ammonia; trichlorophosphate; In pyridine; methanol;

upstream raw materials:

N-[2-(2-benzoylamino-ethyl)-thiazole-4-carbonyl]-cysteine ethyl ester

β-benzamidothiopropionamide

2-(2-benzoylamino-ethyl)-thiazole-4-carboxylic acid amide

2-(2-benzoylamino-ethyl)-thiazole-4-carbonitrile