Ethyl 4-{3-[3-hydroxy-4-(4-methylphenylmethoxy)benzoyl]indol-1-yl}butanoate

HCID 19085543

Basic information

Standard SMILES
CCOC(=O)CCCn1cc(C(=O)c2ccc(OCc3ccc(C)cc3)c(O)c2)c2ccccc21
InChIKey
KPEFBZWKDDLEQK-UHFFFAOYSA-N
Molecular formula
C29H29NO5
Average molar mass
471.5 g/mol

Names & identifiers

Preferred name
Ethyl 4-{3-[3-hydroxy-4-(4-methylphenylmethoxy)benzoyl]indol-1-yl}butanoate
IUPAC
ethyl 4-[3-[3-hydroxy-4-[(4-methylphenyl)methoxy]benzoyl]indol-1-yl]butanoate

Names & synonyms

SCHEMBL7859329KPEFBZWKDDLEQK-UHFFFAOYSA-NEthyl 4-{3-[3-hydroxy-4-(4-methylphenylmethoxy) benzoyl]indol-1-yl}butanoateethyl 4-{3-[3-hydroxy-4-(4-methylphenylmethoxy)benzoyl]indol-1-yl}butanoate

Database identifiers

PubChem CID
19085543

Properties

Computed structural properties

XLogP
5.3
Topological polar surface area
77.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
11
Heavy atoms
35

Related reactions

4 records

Linked notes

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