2-((1H-Benzo[d]imidazol-2-yl)thio)-N-(4-fluoro-3-nitrophenyl)acetamide

• Catalog: OFC299198791
• CAS: 299198-79-1
• Category: Fluorinated Benzimidazoles
• Synonyms: 2-(1H-benzimidazol-2-ylsulfanyl)-N-(4-fluoro-3-nitrophenyl)acetamide
• Purity: 97%
• MDL Number: MFCD00382997

• IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-(4-fluoro-3-nitrophenyl)acetamide
• InChI: InChI=1S/C15H11FN4O3S/c16-10-6-5-9(7-13(10)20(22)23)17-14(21)8-24-15-18-11-3-1-2-4-12(11)19-15/h1-7H,8H2,(H,17,21)(H,18,19)
• InChI Key: FPLAUQPIWAEVOZ-UHFFFAOYSA-N
• Isomeric SMILES: C1=CC=C2C(=C1)NC(=N2)SCC(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-]

• Molecular Formula: C15H11FN4O3S
• Molecular Weight: 346.34

• XLogP3-AA: 3.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 4
• Exact Mass: 346.05358956 g/mol
• Monoisotopic Mass: 346.05358956 g/mol
• Topological Polar Surface Area: 129Ų
• Heavy Atom Count: 24
• Formal Charge: 0
• Complexity: 478