1-benzenesulfonyl-3-(3,4-dimethoxy-phenyl)-1H-indole

HCID 57891749
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Basic information

Standard SMILES
COc1ccc(-c2cn(S(=O)(=O)c3ccccc3)c3ccccc23)cc1OC
InChIKey
HVSFCAFTPVZUFK-UHFFFAOYSA-N
Molecular formula
C22H19NO4S
Average molar mass
393.5 g/mol

Names & identifiers

Preferred name
1-benzenesulfonyl-3-(3,4-dimethoxy-phenyl)-1H-indole
IUPAC
1-(benzenesulfonyl)-3-(3,4-dimethoxyphenyl)indole

Names & synonyms

SCHEMBL4338217HVSFCAFTPVZUFK-UHFFFAOYSA-N1-Benzenesulfonyl-3-(3,4-dimethoxy-phenyl)-indole1-benzenesulfonyl-3-(3,4-dimethoxy-phenyl)-1H-indole

Database identifiers

PubChem CID
57891749

Properties

Computed structural properties

XLogP
4.8
Topological polar surface area
65.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
28

Related reactions

3 records
New reaction record

Compound notes

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