Molecule ID: 13909285

IUPAC Name: 2-(5-butylthiophen-2-yl)-1H-pyrazolo[4,3-c]quinolin-3-one

Description: The molecule is a pyrazoloquinoline that is 2,5-dihydropyrazolo[4,3-c]quinolin-3-one which is substituted at position 2 by a 5-butyl-2-thienyl group. It is a pyrazoloquinoline and a member of thiophenes.

SMILES: CCCCc1ccc(-n2[nH]c3c(cnc4ccccc43)c2=O)s1

SELFIES: [C][C][C][C][C][=C][C][=C][Branch2][Ring1][#Branch1][N][NH1][C][=C][Branch1][=N][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#Branch2][C][Ring1][=N][=O][S][Ring2][Ring1][Ring1]

InChI: InChI=1S/C18H17N3OS/c1-2-3-6-12-9-10-16(23-12)21-18(22)14-11-19-15-8-5-4-7-13(15)17(14)20-21/h4-5,7-11,20H,2-3,6H2,1H3

Molecular Properties:
- Polar Surface Area: 73.5 Ų
- LogP: 4.9