1-Cyclopropyl-7-(3-((ethylamino)methyl)pyrrolidin-1-yl)-6,8-difluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

• Catalog: OFC99734971
• CAS: 99734-97-1
• Category: Fluorinated Quinolines
• Synonyms: 3-Quinolinecarboxylic acid, 1-cyclopropyl-7-[3-[(ethylaMino)Methyl]-1-pyrrolidinyl]-6,8-difluoro-1,4
• Purity: 97%

• IUPAC Name: 1-cyclopropyl-7-[3-(ethylaminomethyl)pyrrolidin-1-yl]-6,8-difluoro-4-oxoquinoline-3-carboxylic acid
• InChI: InChI=1S/C20H23F2N3O3/c1-2-23-8-11-5-6-24(9-11)18-15(21)7-13-17(16(18)22)25(12-3-4-12)10-14(19(13)26)20(27)28/h7,10-12,23H,2-6,8-9H2,1H3,(H,27,28)
• InChI Key: WDBGUJBLPRXPIX-UHFFFAOYSA-N
• Isomeric SMILES: CCNCC1CCN(C1)C2=C(C=C3C(=C2F)N(C=C(C3=O)C(=O)O)C4CC4)F

• Molecular Formula: C20H23F2N3O3
• Molecular Weight: 391.41

• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 6
• Exact Mass: 391.17074793 g/mol
• Monoisotopic Mass: 391.17074793 g/mol
• Topological Polar Surface Area: 72.9Ų
• Heavy Atom Count: 28
• Formal Charge: 0
• Complexity: 669