Molecule ID: 54676329

IUPAC Name: 4-hydroxy-1-(3-methylbutyl)-N-(5-methyl-1,3-thiazol-2-yl)-2-oxoquinoline-3-carboxamide

Description: The molecule is a member of the class of quinolones that is the amide obtained from formal condensation of the carboxy group of 4-hydroxy-1-isopentyl-2-oxo-1,2-dihydroquinoline-3-carboxylic acid with the amino group of 2-amino-3-methyl-1,3-thiazole. It is a member of 1,3-thiazoles, a monocarboxylic acid amide, a monohydroxyquinoline and a quinolone.

SMILES: Cc1cnc(N=C(O)c2c(O)c3ccccc3n(CCC(C)C)c2=O)s1

SELFIES: [C][C][=C][N][=C][Branch2][Ring1][P][N][=C][Branch1][C][O][C][=C][Branch1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch1][Branch2][C][C][C][Branch1][C][C][C][C][Ring1][S][=O][S][Ring2][Ring1][=Branch2]

InChI: InChI=1S/C19H21N3O3S/c1-11(2)8-9-22-14-7-5-4-6-13(14)16(23)15(18(22)25)17(24)21-19-20-10-12(3)26-19/h4-7,10-11,23H,8-9H2,1-3H3,(H,20,21,24)

Molecular Properties:
- Polar Surface Area: 111.0 Ų
- LogP: 3.9