2-[2-Fluoro-4-(8-methoxy-4-oxo-4,5-dihydrothieno[2,3-c]quinolin-9-yl)phenyl]acetonitrile

HCID 67448908
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Basic information

Standard SMILES
COc1ccc2[nH]c(=O)c3sccc3c2c1-c1ccc(CC#N)c(F)c1
InChIKey
IYHLHWBKYIONDN-UHFFFAOYSA-N
Molecular formula
C20H13FN2O2S
Average molar mass
364.4 g/mol

Names & identifiers

Preferred name
2-[2-Fluoro-4-(8-methoxy-4-oxo-4,5-dihydrothieno[2,3-c]quinolin-9-yl)phenyl]acetonitrile
IUPAC
2-[2-fluoro-4-(8-methoxy-4-oxo-5H-thieno[2,3-c]quinolin-9-yl)phenyl]acetonitrile

Names & synonyms

SCHEMBL2550041IYHLHWBKYIONDN-UHFFFAOYSA-N2-[2-Fluoro-4-(8-methoxy-4-oxo-4,5-dihydrothieno[2,3-c]quinolin-9-yl)phenyl]acetonitrile

Database identifiers

PubChem CID
67448908

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
90.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
26

Related reactions

2 records
New reaction record

Compound notes

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