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Methisazone

Base Information Edit
  • Chemical Name:Methisazone
  • CAS No.:1910-68-5
  • Molecular Formula:C10H10 N4 O S
  • Molecular Weight:234.282
  • Hs Code.:2933790090
  • European Community (EC) Number:217-616-2
  • NSC Number:70969,69811
  • UNII:K3QML4J07E
  • DSSTox Substance ID:DTXSID7046413,DTXSID10859687
  • Nikkaji Number:J9.535D
  • Wikipedia:Metisazone
  • Wikidata:Q4562049
  • NCI Thesaurus Code:C77928
  • ChEMBL ID:CHEMBL362994,CHEMBL1512080,CHEMBL4777221,CHEMBL2354555
  • Mol file:1910-68-5.mol
Methisazone

Synonyms:Marboran;Methisazone;Metisazone

Suppliers and Price of Methisazone
Supply Marketing:Edit
Business phase:
The product has achieved commercial mass production*data from LookChem market partment
Manufacturers and distributors:
  • Manufacture/Brand
  • Chemicals and raw materials
  • Packaging
  • price
  • Aronis compounds
  • 1-methyl-1H-indole-2,3-dione3-thiosemicarbazone
  • 10g
  • $ 505.00
  • American Custom Chemicals Corporation
  • N-METHYLISATIN-3-THIOSEMICARBAZONE 98.00%
  • 1G
  • $ 1250.87
  • AHH
  • N-Methylisatin-3-thiosemicarbazone 98%
  • 1g
  • $ 510.00
Total 43 raw suppliers
Chemical Property of Methisazone Edit
Chemical Property:
  • Vapor Pressure:6.07E-07mmHg at 25°C 
  • Melting Point:245° 
  • Refractive Index:1.6390 (estimate) 
  • Boiling Point:410.3 °C at 760 mmHg 
  • PKA:9.81±0.20(Predicted) 
  • Flash Point:202 °C 
  • PSA:102.81000 
  • Density:1.47 g/cm3 
  • LogP:1.35650 
  • XLogP3:2
  • Hydrogen Bond Donor Count:2
  • Hydrogen Bond Acceptor Count:3
  • Rotatable Bond Count:1
  • Exact Mass:234.05753213
  • Heavy Atom Count:16
  • Complexity:309
Purity/Quality:

99%, *data from raw suppliers

1-methyl-1H-indole-2,3-dione3-thiosemicarbazone *data from reagent suppliers

Safty Information:
  • Pictogram(s):  
  • Hazard Codes: 
MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:CN1C2=CC=CC=C2C(=C1O)N=NC(=S)N
  • Uses Antiviral.
Technology Process of Methisazone

There total 9 articles about Methisazone 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:
Guidance literature:
2′-N,N-dimethylaminophenylacetylene; With iodine; oxygen; In dimethyl sulfoxide; at 20 - 100 ℃; for 6h;
thiosemicarbazide; With diethylamine; In dimethylsulfoxide-d6; at 20 ℃; for 3h;
DOI:10.1021/acs.joc.5b00581
Guidance literature:
Multi-step reaction with 4 steps
1.1: methyllithium / tetrahydrofuran / 1.5 h / -78 °C / Inert atmosphere
1.2: 3.17 h / 20 °C / Inert atmosphere
2.1: tri tert-butylphosphoniumtetrafluoroborate; bis(dibenzylideneacetone)-palladium(0); 1,8-diazabicyclo[5.4.0]undec-7-ene / tetrahydrofuran / 16 h / 20 °C / Glovebox; Inert atmosphere; Sealed tube
2.2: 16 h / 20 °C / Sealed tube; Inert atmosphere
3.1: hydrogenchloride / tetrahydrofuran; water / 5 h / 70 °C
4.1: acetic acid / 2 h / 120 °C
With hydrogenchloride; methyllithium; acetic acid; 1,8-diazabicyclo[5.4.0]undec-7-ene; bis(dibenzylideneacetone)-palladium(0); tri tert-butylphosphoniumtetrafluoroborate; In tetrahydrofuran; water;
DOI:10.1002/ejoc.201600143
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