2-Fluoro-5-[6-(1-methanesulfonyl-1-methyl-ethyl)-quinolin-8-yl]-benzaldehyde

HCID 21865564
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Basic information

Standard SMILES
CC(C)(c1cc(-c2ccc(F)c(C=O)c2)c2ncccc2c1)S(C)(=O)=O
InChIKey
PANBJVBSHJCDTI-UHFFFAOYSA-N
Molecular formula
C20H18FNO3S
Average molar mass
371.4 g/mol

Names & identifiers

Preferred name
2-Fluoro-5-[6-(1-methanesulfonyl-1-methyl-ethyl)-quinolin-8-yl]-benzaldehyde
IUPAC
2-fluoro-5-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]benzaldehyde

Names & synonyms

SCHEMBL4035622PANBJVBSHJCDTI-UHFFFAOYSA-N2-Fluoro-5-[6-(1-methanesulfonyl-1-methyl-ethyl)-quinolin-8-yl]-benzaldehyde

Database identifiers

PubChem CID
21865564

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
72.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
26

Related reactions

2 records
New reaction record

Compound notes

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