N-{[4-(acetylamino)phenyl]carbamothioyl}-3-bromobenzamide

Base Information

• Chemical Name: N-{[4-(acetylamino)phenyl]carbamothioyl}-3-bromobenzamide
• CAS No.: 6406-47-9
• Molecular Formula: C28H23 N5 O8 S2 . 2 Na
• Molecular Weight: 392.2703
• European Community (EC) Number: 613-433-0
• DSSTox Substance ID: DTXSID70367677
• Wikidata: Q82153675
• Mol file: 6406-47-9.mol

Synonyms:N-{[4-(acetylamino)phenyl]carbamothioyl}-3-bromobenzamide;ZINC02981834;6406-47-9;N-[(4-acetamidophenyl)carbamothioyl]-3-bromobenzamide;DTXSID70367677;STK131842;AKOS003227152;AB00107145-01;SR-01000233777;SR-01000233777-1

Chemical Property of N-{[4-(acetylamino)phenyl]carbamothioyl}-3-bromobenzamide

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 109.30000
• Density: 1.582g/cm³
• LogP: 4.83160
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 390.99901
• Heavy Atom Count: 23
• Complexity: 453

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)NC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=CC=C2)Br

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