[(4-Phenylmethoxyphenyl)methylideneamino]thiourea

Base Information

• Chemical Name: [(4-Phenylmethoxyphenyl)methylideneamino]thiourea
• CAS No.: 101091-29-6
• Molecular Formula: C15H15 N3 O S
• Molecular Weight: 285.37
• Hs Code.: 2930909090
• European Community (EC) Number: 658-286-3
• DSSTox Substance ID: DTXSID90354882
• Mol file: 101091-29-6.mol

Synonyms:[(4-phenylmethoxyphenyl)methylideneamino]thiourea;101091-29-6;Hydrazinecarbothioamide,2-[[4-(phenylmethoxy)phenyl]methylene]-;SCHEMBL4331982;DTXSID90354882;AKOS017263680

Chemical Property of [(4-Phenylmethoxyphenyl)methylideneamino]thiourea

Chemical Property:

• Melting Point: 188-189 °C
• Boiling Point: 459.8±47.0 °C(Predicted)
• PKA: 11.33±0.70(Predicted)
• PSA: 96.27000
• Density: 1.19±0.1 g/cm3(Predicted)
• LogP: 3.54430
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 285.09358328
• Heavy Atom Count: 20
• Complexity: 321

Purity/Quality:

99%min ^*data from raw suppliers

4-(benzyloxy)benzaldehydethiosemicarbazone ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)COC2=CC=C(C=C2)C=NNC(=S)N

Technology Process of [(4-Phenylmethoxyphenyl)methylideneamino]thiourea

There total 1 articles about [(4-Phenylmethoxyphenyl)methylideneamino]thiourea 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: 91.0%

p-benzyloxybenzaldehyde (4397-53-9) + thiosemicarbazide (79-19-6) → (E)-2-(4-(benzyloxy)benzylidene)hydrazinecarbothioamide (101091-29-6)

Guidance literature:

With acetic acid; In ethanol; for 4h; Reflux;

Reference yield: 81.0%

(E)-2-(4-(benzyloxy)benzylidene)hydrazinecarbothioamide (101091-29-6) + 4-chlorobenzoylmethyl bromide (536-38-9) → (E)-2-(2-(4-(benzyloxy)benzylidene)hydrazinyl)-4-(4-chlorophenyl)thiazole

Guidance literature:

DOI:10.1016/j.bioorg.2015.06.006

Reference yield: 81.0%

(E)-2-(4-(benzyloxy)benzylidene)hydrazinecarbothioamide (101091-29-6) + 2-Bromo-4'-methoxyacetophenone (2632-13-5) → (E)-2-(2-(4-(benzyloxy)benzylidene)hydrazinyl)-4-(4-methoxyphenyl)thiazole

Guidance literature:

DOI:10.1016/j.bioorg.2015.06.006

upstream raw materials:

p-benzyloxybenzaldehyde

thiosemicarbazide

Refernces

• 1、 Hussain, Shafqat,Khan, Farman Ali,Khan, Khalid Mohammed,Lodhi, Muhammad Arif,Naz, Fouzia,Perveen, Shahnaz,Qureshi, Bakhtawer,Salar, Uzma,Taha, Muhammad,Ul?Haq, Zaheer. "Aryl hydrazones linked thiazolyl coumarin hybrids as potential urease inhibitors". . . Retrieved 2021/08/20.
• 2、 Rahim, Fazal,Zaman, Khalid,Ullah, Hayat,Taha, Muhammad,Wadood, Abdul,Javed, Muhammad Tariq,Rehman, Wajid,Ashraf, Muhammad,Uddin, Reaz,Uddin, Imad,Asghar, Humna,Khan, Aftab Ahmad,Khan, Khalid M.. "Synthesis of 4-thiazolidinone analogs as potent in vitro anti-urease agents". . p. 123 - 131. Retrieved 2015/11/09.