1-phenyl-3-[(Z)-[phenyl(2-pyridyl)methylene]amino]thiourea

Base Information

• Chemical Name: 1-phenyl-3-[(Z)-[phenyl(2-pyridyl)methylene]amino]thiourea
• CAS No.: 65518-40-3
• Molecular Formula: C19H16N4S
• Molecular Weight: 332.429
• NSC Number: 668322,143167
• Nikkaji Number: J1.985.874J,J2.311.331G
• ChEMBL ID: CHEMBL589674

Synonyms:NSC668322;CHEMBL589674;65518-40-3;DNDI1417445;NSC143167;NSC-143167;NSC-668322;SJ000124961;2-Pyridylphenylmethanone 4-phenyl thiosemicarbazone;(E)-2-Pyridinylphenyl ketone 4-phenylthiosemicarbazone;(Z)-Phenyl(2-pyridinyl)methanone N-phenylthiosemicarbazone;1-phenyl-3-[(Z)-[phenyl(2-pyridyl)methylene]amino]thiourea

Chemical Property of 1-phenyl-3-[(Z)-[phenyl(2-pyridyl)methylene]amino]thiourea

Chemical Property:

• Vapor Pressure: 5.1E-10mmHg at 25°C
• Boiling Point: 497.1°Cat760mmHg
• Flash Point: 254.4°C
• Density: 1.18g/cm³
• XLogP3: 4.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 332.10956770
• Heavy Atom Count: 24
• Complexity: 425

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C(=NNC(=S)NC2=CC=CC=C2)C3=CC=CC=N3
• Isomeric SMILES: C1=CC=C(C=C1)/C(=N/NC(=S)NC2=CC=CC=C2)/C3=CC=CC=N3

Technology Process of 1-phenyl-3-[(Z)-[phenyl(2-pyridyl)methylene]amino]thiourea

There total 4 articles about 1-phenyl-3-[(Z)-[phenyl(2-pyridyl)methylene]amino]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: 87.0%

phenyl(pyridin-2-yl)methanone (91-02-1) + 4-Phenyl-3-thiosemicarbazide (5351-69-9) → N-phenyl-2-(phenyl-2-pyridinylmethylene)hydrazinecarbothioamide (65518-40-3)

Guidance literature:

With acetic acid; In methanol; for 5h; Reflux;

DOI:10.1016/j.poly.2018.11.023

Reference yield: 84.0%

→ N-phenyl-2-(phenyl-2-pyridinylmethylene)hydrazinecarbothioamide (65518-40-3)

Guidance literature:

Reference yield: 59.0%

phenyl(pyridin-2-yl)methanone (91-02-1) + 1-phenyl-3-thiosemicarbazide (645-48-7) → N-phenyl-2-(phenyl-2-pyridinylmethylene)hydrazinecarbothioamide (65518-40-3)

Guidance literature:

With hydrogenchloride; In ethanol; at 95 ℃; for 6h;

DOI:10.1039/c3ob41109e

upstream raw materials:

phenyl(pyridin-2-yl)methanone

4-Phenyl-3-thiosemicarbazide

phenyl isothiocyanate

1-phenyl-3-thiosemicarbazide

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