4-(2-methoxyphenyl)-3-phenyl-1H-1,2,4-triazole-5-thione

Base Information

Chemical Name:4-(2-methoxyphenyl)-3-phenyl-1H-1,2,4-triazole-5-thione
CAS No.:19993-93-2
Molecular Formula:C15H13N3OS
Molecular Weight:283.354
Hs Code.:
DSSTox Substance ID:DTXSID201326281
ChEMBL ID:CHEMBL1460460

Synonyms:MLS000689122;4-(2-methoxyphenyl)-3-phenyl-1H-1,2,4-triazole-5-thione;SMR000283119;Oprea1_294173;cid_863515;CHEMBL1460460;BDBM47782;DTXSID201326281;HMS2710C17;STK891271;AKOS001432197;UPCMLD0ENAT5960188:001;Z283858708;4-(2-methoxyphenyl)-5-phenyl-4H-1,2,4-triazole-3-thiol;19993-93-2

Suppliers and Price of 4-(2-methoxyphenyl)-3-phenyl-1H-1,2,4-triazole-5-thione

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 4-(2-methoxyphenyl)-3-phenyl-1H-1,2,4-triazole-5-thione

Chemical Property:

XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:283.07793322
Heavy Atom Count:20
Complexity:393

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:COC1=CC=CC=C1N2C(=NNC2=S)C3=CC=CC=C3

Technology Process of 4-(2-methoxyphenyl)-3-phenyl-1H-1,2,4-triazole-5-thione

There total 9 articles about 4-(2-methoxyphenyl)-3-phenyl-1H-1,2,4-triazole-5-thione 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:

: 516458-14-3
1-benzoyl-4-(2-methoxy-phenyl)-thiosemicarbazide

: 19993-93-2
4-(2-methoxy-phenyl)-5-phenyl-2,4-dihydro-[1,2,4]triazole-3-thione

Guidance literature:: With sodium hydroxide; In water; at 70 - 80 ℃;
DOI:10.1007/s11030-020-10102-5

Reference yield:

: 93-89-0,99341-95-4
benzoic acid ethyl ester

: 19993-93-2
4-(2-methoxy-phenyl)-5-phenyl-2,4-dihydro-[1,2,4]triazole-3-thione

Guidance literature:: Multi-step reaction with 3 steps

1: hydrazine hydrate / ethanol / Reflux

2: ethanol / 20 °C / Inert atmosphere

3: sodium hydroxide / water / 70 - 80 °C

With hydrazine hydrate; sodium hydroxide; In ethanol; water;
DOI:10.1007/s11030-020-10102-5

Reference yield:

: 613-94-5
benzoic acid hydrazide

: 19993-93-2
4-(2-methoxy-phenyl)-5-phenyl-2,4-dihydro-[1,2,4]triazole-3-thione

Guidance literature:: Multi-step reaction with 2 steps

1: ethanol / 20 °C / Inert atmosphere

2: sodium hydroxide / water / 70 - 80 °C

With sodium hydroxide; In ethanol; water;
DOI:10.1007/s11030-020-10102-5