5-Benzyloxy-3-(3-chloro-phenyl)-2-methyl-1H-indole

HCID 20529201
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Basic information

CAS
76458-93-0
Standard SMILES
Cc1[nH]c2ccc(OCc3ccccc3)cc2c1-c1cccc(Cl)c1
InChIKey
HGYGBUUZQMMDJR-UHFFFAOYSA-N
Molecular formula
C22H18ClNO
Average molar mass
347.8 g/mol
Monoisotopic mass
347.10769188

Names & identifiers

Preferred name
5-Benzyloxy-3-(3-chloro-phenyl)-2-methyl-1H-indole
IUPAC
3-(3-chlorophenyl)-2-methyl-5-phenylmethoxy-1H-indole

Names & synonyms

5-Benzyloxy-3-(3-chloro-phenyl)-2-methyl-1H-indoleSCHEMBL11260793HGYGBUUZQMMDJR-UHFFFAOYSA-NDTXSID60120562776458-93-05-(Benzyloxy)-3-(3-chlorophenyl)-2-methyl-1H-indole3-(3-Chlorophenyl)-2-methyl-5-(phenylmethoxy)-1H-indole

Database identifiers

CAS
76458-93-0
PubChem CID
20529201
DTXSID
DTXSID601205627

Properties

Computed structural properties

XLogP
6.2
Topological polar surface area
25 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
4
Heavy atoms
25

Related reactions

3 records
New reaction record

Compound notes

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