N-[(5-bromopyridin-2-yl)carbamothioyl]furan-2-carboxamide

Base Information

• Chemical Name: N-[(5-bromopyridin-2-yl)carbamothioyl]furan-2-carboxamide
• CAS No.: 6137-91-3
• Molecular Formula: C5H7 N O5
• Molecular Weight: 326.1691
• DSSTox Substance ID: DTXSID00400809
• Wikidata: Q82203835

Synonyms:N-[(5-bromopyridin-2-yl)carbamothioyl]furan-2-carboxamide;STK034221;6137-91-3;CBMicro_004426;DTXSID00400809;SMSF0014889;AKOS003230627;CB06680;BIM-0004454.P001

Chemical Property of N-[(5-bromopyridin-2-yl)carbamothioyl]furan-2-carboxamide

Chemical Property:

• Boiling Point: 267.5±23.0 °C(Predicted)
• PKA: 3.48±0.41(Predicted)
• PSA: 109.78000
• Density: 1.709g/cm³
• LogP: 3.35920
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 324.95206
• Heavy Atom Count: 18
• Complexity: 329

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=COC(=C1)C(=O)NC(=S)NC2=NC=C(C=C2)Br

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