3-(4-Chlorophenoxy)-2-methyl-5-(methylsulfonyl)-1H-indole-1-acetic acid

HCID 11661164
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Basic information

Standard SMILES
Cc1c(Oc2ccc(Cl)cc2)c2cc(S(C)(=O)=O)ccc2n1CC(=O)O
InChIKey
JFDVCWFRJKHBAG-UHFFFAOYSA-N
Molecular formula
C18H16ClNO5S
Average molar mass
393.8 g/mol
Monoisotopic mass
393.0437715

Names & identifiers

Preferred name
3-(4-Chlorophenoxy)-2-methyl-5-(methylsulfonyl)-1H-indole-1-acetic acid
IUPAC
2-[3-(4-chlorophenoxy)-2-methyl-5-methylsulfonylindol-1-yl]acetic acid

Names & synonyms

SCHEMBL3371546JFDVCWFRJKHBAG-UHFFFAOYSA-N3-(4-Chlorophenoxy)-2-methyl-5-(methylsulfonyl)-1H-indole-1-acetic acid

Database identifiers

PubChem CID
11661164

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
94 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
26

Related reactions

1 records
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Linked notes

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