1-(6-Fluoro-4-methylquinolin-2-yl)-3-methyl-1,4-dihydroindeno[1,2-c]pyrazole

• Catalog: OFC130946702
• CAS: 130946-70-2
• Category: Fluorinated Quinolines
• Synonyms: Indeno(1,2-c)pyrazole, 1,4-dihydro-1-(6-fluoro-4-methyl-2-quinolinyl)-3-methyl-
• Purity: 97%

• IUPAC Name: 1-(6-fluoro-4-methylquinolin-2-yl)-3-methyl-4H-indeno[1,2-c]pyrazole
• InChI: InChI=1S/C21H16FN3/c1-12-9-20(23-19-8-7-15(22)11-17(12)19)25-21-16-6-4-3-5-14(16)10-18(21)13(2)24-25/h3-9,11H,10H2,1-2H3
• InChI Key: BRSYQAAQRBKEEW-UHFFFAOYSA-N
• Isomeric SMILES: CC1=CC(=NC2=C1C=C(C=C2)F)N3C4=C(CC5=CC=CC=C54)C(=N3)C

• Molecular Formula: C21H16FN3
• Molecular Weight: 329.37

• XLogP3-AA: 5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 329.13282569 g/mol
• Monoisotopic Mass: 329.13282569 g/mol
• Topological Polar Surface Area: 30.7Ų
• Heavy Atom Count: 25
• Formal Charge: 0
• Complexity: 500