2,4-Difluorobenzenesulfonic acid 3-(1-methylpiperidin-4-yl)-1H-indol-5-yl ester

HCID 10294752
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Basic information

Standard SMILES
CN1CCC(c2c[nH]c3ccc(OS(=O)(=O)c4ccc(F)cc4F)cc23)CC1
InChIKey
WIOSJFRMWVIGMD-UHFFFAOYSA-N
Molecular formula
C20H20F2N2O3S
Average molar mass
406.4 g/mol

Names & identifiers

Preferred name
2,4-Difluorobenzenesulfonic acid 3-(1-methylpiperidin-4-yl)-1H-indol-5-yl ester
IUPAC
[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl] 2,4-difluorobenzenesulfonate

Names & synonyms

SCHEMBL5374640WIOSJFRMWVIGMD-UHFFFAOYSA-N2,4-Difluorobenzenesulfonic acid 3-(1-methylpiperidin-4-yl)-1H-indol-5-yl ester

Database identifiers

PubChem CID
10294752

Properties

Computed structural properties

XLogP
3.9
Topological polar surface area
70.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
4
Heavy atoms
28

Related reactions

2 records
New reaction record

Compound notes

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