3-Methyl-6-(methylthio)-2-[3-(trifluoromethyl)phenyl]-4-quinolinecarboxylic acid

HCID 67418352
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
CSc1ccc2nc(-c3cccc(C(F)(F)F)c3)c(C)c(C(=O)O)c2c1
InChIKey
ZDNQTBSSWWDPDS-UHFFFAOYSA-N
Molecular formula
C19H14F3NO2S
Average molar mass
377.4 g/mol

Names & identifiers

Preferred name
3-Methyl-6-(methylthio)-2-[3-(trifluoromethyl)phenyl]-4-quinolinecarboxylic acid
IUPAC
3-methyl-6-methylsulfanyl-2-[3-(trifluoromethyl)phenyl]quinoline-4-carboxylic acid

Names & synonyms

3-methyl-6-(methylthio)-2-[3-(trifluoromethyl)phenyl]-4-quinolinecarboxylic acidSCHEMBL2464727

Database identifiers

PubChem CID
67418352

Properties

Computed structural properties

XLogP
5.1
Topological polar surface area
75.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
3
Heavy atoms
26

Related reactions

2 records
New reaction record

Compound notes

Loading…