N-[(5-bromopyridin-2-yl)carbamothioyl]-2-phenylquinoline-4-carboxamide

Base Information

• Chemical Name: N-[(5-bromopyridin-2-yl)carbamothioyl]-2-phenylquinoline-4-carboxamide
• CAS No.: 438613-82-2
• Molecular Formula: C22H15BrN4OS
• Molecular Weight: 463.4
• DSSTox Substance ID: DTXSID001142144
• Mol file: 438613-82-2.mol

Synonyms:N-[(5-bromopyridin-2-yl)carbamothioyl]-2-phenylquinoline-4-carboxamide;Oprea1_410631;AK-968/41017008;DTXSID001142144;STK301359;AKOS003791348;N-(5-bromo-2-pyridinyl)-N'-[(2-phenyl-4-quinolinyl)carbonyl]thiourea;N-[[(5-Bromo-2-pyridinyl)amino]thioxomethyl]-2-phenyl-4-quinolinecarboxamide;438613-82-2

Chemical Property of N-[(5-bromopyridin-2-yl)carbamothioyl]-2-phenylquinoline-4-carboxamide

Chemical Property:

• XLogP3: 5.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 462.01499
• Heavy Atom Count: 29
• Complexity: 585

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC(=S)NC4=NC=C(C=C4)Br