1-(2-(Trifluoromethyl)quinolin-4-yl)-1H-indole-3-carboxylic acid

• Catalog: OFC649539004
• CAS: 649539-00-4
• Category: Fluorinated Quinolines
• Synonyms: 3-Carboxy-1-(2-(trifluoromethyl)quinol-4-yl )-1H-indole
• Purity: 97%

• IUPAC Name: 1-[2-(trifluoromethyl)quinolin-4-yl]indole-3-carboxylic acid
• InChI: InChI=1S/C19H11F3N2O2/c20-19(21,22)17-9-16(12-6-1-3-7-14(12)23-17)24-10-13(18(25)26)11-5-2-4-8-15(11)24/h1-10H,(H,25,26)
• InChI Key: UCFSTHWNSHAERU-UHFFFAOYSA-N
• Isomeric SMILES: C1=CC=C2C(=C1)C(=CC(=N2)C(F)(F)F)N3C=C(C4=CC=CC=C43)C(=O)O

• Molecular Formula: C19H11F3N2O2
• Molecular Weight: 356.30

• XLogP3-AA: 4.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 2
• Exact Mass: 356.07726208 g/mol
• Monoisotopic Mass: 356.07726208 g/mol
• Topological Polar Surface Area: 55.1Ų
• Heavy Atom Count: 26
• Formal Charge: 0
• Complexity: 541