N-quinolin-5-ylthiourea

Base Information

• Chemical Name: N-quinolin-5-ylthiourea
• CAS No.: 860621-03-0
• Molecular Formula: C₁₀H₉N₃S
• Molecular Weight: 203.268
• European Community (EC) Number: 853-715-2
• Mol file: 860621-03-0.mol

Synonyms:N-quinolin-5-ylthiourea;860621-03-0;quinolin-5-ylthiourea;(quinolin-5-yl)thiourea;1-(Quinolin-5-yl)thiourea;MFCD03305522;1-quinolin-5-ylthiourea;N-(5-quinolinyl)thiourea;N-(5-quinolyl)thiourea;SCHEMBL4511393;quinolin-5-ylthiourea, AldrichCPR;BBL029942;STK940931;AKOS005175269;NCGC00324964-01;CS-0252110;EN300-59005;2N-012;AB01319669-02;A917649

Chemical Property of N-quinolin-5-ylthiourea

Chemical Property:

• XLogP3: 1.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 203.05171847
• Heavy Atom Count: 14
• Complexity: 219

Purity/Quality:

97% ^*data from raw suppliers

N-Quinolin-5-ylthiourea ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn
• Statements: 22

MSDS Files:

Useful:

• Canonical SMILES: C1=CC2=C(C=CC=N2)C(=C1)NC(=S)N

Technology Process of N-quinolin-5-ylthiourea

There total 3 articles about N-quinolin-5-ylthiourea 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: 90.0%

1-benzoyl-3-quinolin-5-yl-thiourea (861208-64-2) → N-quinolin-5-ylthiourea (860621-03-0)

Guidance literature:

With sodium hydroxide; at 98 ℃; for 0.166667h;

DOI:10.1016/j.bmcl.2006.01.126

Reference yield:

5-Aminoquinoline (611-34-7,146614-41-7) → N-quinolin-5-ylthiourea (860621-03-0)

Guidance literature:

Multi-step reaction with 2 steps

1: 98 percent / acetone / 1 h / 20 °C

2: 90 percent / aq. NaOH / 0.17 h / 98 °C

With sodium hydroxide; In acetone;

DOI:10.1016/j.bmcl.2006.01.126

Reference yield:

→ N-quinolin-5-ylthiourea (860621-03-0)

Guidance literature:

upstream raw materials:

1-benzoyl-3-quinolin-5-yl-thiourea

5-Aminoquinoline

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