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Technology Process of 4-(2,3-Dihydrobenzo[b][1,4]dioxin-6-yl)-3-((5-nitrothiazol-2-yl)thio)-1H-1,2,4-triazol-5(4H)-one

4-(2,3-Dihydrobenzo[b][1,4]dioxin-6-yl)-3-((5-nitrothiazol-2-yl)thio)-1H-1,2,4-triazol-5(4H)-one

Base Information
  • Chemical Name:4-(2,3-Dihydrobenzo[b][1,4]dioxin-6-yl)-3-((5-nitrothiazol-2-yl)thio)-1H-1,2,4-triazol-5(4H)-one
  • CAS No.:883065-90-5
  • Molecular Formula:C13H9N5O5S2
  • Molecular Weight:379.3711
  • Hs Code.:2934999090
  • DSSTox Substance ID:DTXSID10372629
  • Wikidata:Q27166523
  • ChEMBL ID:CHEMBL508280
  • Mol file:883065-90-5.mol
4-(2,3-Dihydrobenzo[b][1,4]dioxin-6-yl)-3-((5-nitrothiazol-2-yl)thio)-1H-1,2,4-triazol-5(4H)-one

Synonyms:4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,4-dihydro-5-((5-nitro-2-thiazolyl)thio)-3H-1,2,4-triazol-3-one;BI-78D3

Suppliers and Price of 4-(2,3-Dihydrobenzo[b][1,4]dioxin-6-yl)-3-((5-nitrothiazol-2-yl)thio)-1H-1,2,4-triazol-5(4H)-one
Supply Marketing:
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
  • Usbiological
  • BI 78D3
  • 10mg
  • $ 466.00
  • TRC
  • BI-78D3
  • 2.5mg
  • $ 45.00
  • Tocris
  • BI78D3 ≥99%(HPLC)
  • 50
  • $ 868.00
  • Tocris
  • BI78D3 ≥99%(HPLC)
  • 10
  • $ 221.00
  • Sigma-Aldrich
  • JNK Inhibitor X, BI-78D3
  • 5mg
  • $ 109.15
  • Sigma-Aldrich
  • BI-78D3 ≥98% (HPLC)
  • 25mg
  • $ 411.00
  • Matrix Scientific
  • 4-(2,3-Dihydrobenzo[b][1,4]dioxin-6-yl)-3-((5-nitro-thiazol-2-yl)thio)-1H-1,2,4-triazol-5(4H)-one 95+%
  • 250mg
  • $ 1664.00
  • DC Chemicals
  • BI-78D3 >98%
  • 1 g
  • $ 1900.00
  • DC Chemicals
  • BI-78D3 >98%
  • 100 mg
  • $ 500.00
  • CSNpharm
  • BI-78D3
  • 10mg
  • $ 102.00
Total 26 raw suppliers
Chemical Property of 4-(2,3-Dihydrobenzo[b][1,4]dioxin-6-yl)-3-((5-nitrothiazol-2-yl)thio)-1H-1,2,4-triazol-5(4H)-one
Chemical Property:
  • Vapor Pressure:0mmHg at 25°C 
  • Refractive Index:1.879 
  • Boiling Point:705.721 °C at 760 mmHg 
  • Flash Point:380.606 °C 
  • PSA：181.39000 
  • Density:1.922g/cm3 
  • LogP:2.37090 
  • Storage Temp.:Store at +4°C 
  • Solubility.:DMSO: >10mg/mL 
  • XLogP3:2.7
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:9
  • Rotatable Bond Count:3
  • Exact Mass:379.00451075
  • Heavy Atom Count:25
  • Complexity:588
Purity/Quality:

99%, *data from raw suppliers

BI 78D3 *data from reagent suppliers

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

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:
  • Canonical SMILES:C1COC2=C(O1)C=CC(=C2)N3C(=O)NN=C3SC4=NC=C(S4)[N+](=O)[O-]
  • Uses BI-78D3 is an inhibitor of JNK mediated signaling. Molecular docking studies on JNK inhibitors at allosteric JNK-JIP interaction site. JNK inhibition by BI-78D3 covalent binding to JNK at Cys163 or displacement of 2-mercapto-5-nitrothiazole, or addition of BI-78D3 oxidation product. A therapeutic target of the vascular JNK pathway which improves retinal endothelial vasodilator function during early diabetes.
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