2-Ethyl-5-fluoro-1-{1-[3-(4-fluoro-phenylsulfanyl)-propyl]-piperidine-4-yl}-1H-indole

HCID 57718844
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Basic information

Standard SMILES
CCc1cc2cc(F)ccc2n1C1CCN(CCCSc2ccc(F)cc2)CC1
InChIKey
CQJWRZQTTVIAJN-UHFFFAOYSA-N
Molecular formula
C24H28F2N2S
Average molar mass
414.6 g/mol

Names & identifiers

Preferred name
2-Ethyl-5-fluoro-1-{1-[3-(4-fluoro-phenylsulfanyl)-propyl]-piperidine-4-yl}-1H-indole
IUPAC
2-ethyl-5-fluoro-1-[1-[3-(4-fluorophenyl)sulfanylpropyl]piperidin-4-yl]indole

Names & synonyms

SCHEMBL4003775CQJWRZQTTVIAJN-UHFFFAOYSA-N2-Ethyl-5-fluoro-1-{1-[3-(4-fluoro-phenylsulfanyl)-propyl]-piperidine-4-yl}-1H-indole

Database identifiers

PubChem CID
57718844

Properties

Computed structural properties

XLogP
6.1
Topological polar surface area
33.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
7
Heavy atoms
29

Related reactions

2 records
New reaction record

Compound notes

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