1-(5-(7-(3-morpholinopropoxy)quinazolin-4-ylthio)-1,3,4-thiadiazol-2-yl)-3-p-tolylurea

Base Information

• Chemical Name: 1-(5-(7-(3-morpholinopropoxy)quinazolin-4-ylthio)-1,3,4-thiadiazol-2-yl)-3-p-tolylurea
• CAS No.: 1370256-78-2
• Molecular Formula: C25H27N7O3S2
• Molecular Weight: 537.66
• Mol file: 1370256-78-2.mol

Synonyms:1-(5-(7-(3-morpholinopropoxy)quinazolin-4-ylthio)-1,3,4-thiadiazol-2-yl)-3-p-tolylurea;N-(4-Methylphenyl)-N'-[5-[[7-[3-(4-morpholinyl)propoxy]-4-quinazolinyl]thio]-1,3,4-thiadiazol-2-yl]urea;SKLB4771

Chemical Property of 1-(5-(7-(3-morpholinopropoxy)quinazolin-4-ylthio)-1,3,4-thiadiazol-2-yl)-3-p-tolylurea

Chemical Property:

• PKA: 6.62±0.50(Predicted)
• PSA: 167.93000
• Density: 1.43±0.1 g/cm3(Predicted)
• LogP: 4.76990

Purity/Quality:

99%, ^*data from raw suppliers

FLT3-IN-1 98+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Uses: FLT3-IN-1, is a FLT3 inhibitor.

Technology Process of 1-(5-(7-(3-morpholinopropoxy)quinazolin-4-ylthio)-1,3,4-thiadiazol-2-yl)-3-p-tolylurea

There total 4 articles about 1-(5-(7-(3-morpholinopropoxy)quinazolin-4-ylthio)-1,3,4-thiadiazol-2-yl)-3-p-tolylurea 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: 59.0%

4-(3-((4-chloro-quinazolin-7-yl)oxy)propyl)morpholine (199327-94-1) + 1-(5-mercapto-[1,3,4]thiadiazol-2-yl)-3-p-tolylurea (710311-95-8) → 1-{5-[7-(3-morpholinopropoxy)quinazolin-4-ylthio][1,3,4]thiadiazol-2-yl}-3-p-tolylurea (1370256-78-2)

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; at 100 ℃;

DOI:10.1021/jm300042x

Reference yield:

3-morpholin-4-ylpropan-1-ol (4441-30-9) → 1-{5-[7-(3-morpholinopropoxy)quinazolin-4-ylthio][1,3,4]thiadiazol-2-yl}-3-p-tolylurea (1370256-78-2)

Guidance literature:

Multi-step reaction with 3 steps

1.1: sodium hydride / N,N-dimethyl-formamide / 0 °C

1.2: 100 °C

2.1: N,N-diethylaniline; trichlorophosphate / N,N-dimethyl-formamide / 3 h / 70 - 90 °C

3.1: potassium carbonate / N,N-dimethyl-formamide / 100 °C

With sodium hydride; potassium carbonate; N,N-diethylaniline; trichlorophosphate; In N,N-dimethyl-formamide;

DOI:10.1021/jm300042x

Reference yield:

7-(3-morpholinopropoxy)quinazolin-4(3H)-one (196603-91-5) → 1-{5-[7-(3-morpholinopropoxy)quinazolin-4-ylthio][1,3,4]thiadiazol-2-yl}-3-p-tolylurea (1370256-78-2)

Guidance literature:

Multi-step reaction with 2 steps

1: N,N-diethylaniline; trichlorophosphate / N,N-dimethyl-formamide / 3 h / 70 - 90 °C

2: potassium carbonate / N,N-dimethyl-formamide / 100 °C

With potassium carbonate; N,N-diethylaniline; trichlorophosphate; In N,N-dimethyl-formamide;

DOI:10.1021/jm300042x

upstream raw materials:

3-morpholin-4-ylpropan-1-ol

4-(3-((4-chloro-quinazolin-7-yl)oxy)propyl)morpholine

1-(5-mercapto-[1,3,4]thiadiazol-2-yl)-3-p-tolylurea

7-(3-morpholinopropoxy)quinazolin-4(3H)-one

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