6-Hydroxy-2-(4-Hydroxyphenyl)-3-(4-[1-Ethylpiperidin-4-oxy]benzoyl)benzo[b]thiophene

HCID 9847697
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Basic information

Standard SMILES
CCN1CCC(Oc2ccc(C(=O)c3c(-c4ccc(O)cc4)sc4cc(O)ccc34)cc2)CC1
InChIKey
ZOOWXYVEBCFLII-UHFFFAOYSA-N
Molecular formula
C28H27NO4S
Average molar mass
473.6 g/mol

Names & identifiers

Preferred name
6-Hydroxy-2-(4-Hydroxyphenyl)-3-(4-[1-Ethylpiperidin-4-oxy]benzoyl)benzo[b]thiophene
IUPAC
[4-(1-ethylpiperidin-4-yl)oxyphenyl]-[6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]methanone

Names & synonyms

SCHEMBL6600584SCHEMBL30558245ZOOWXYVEBCFLII-UHFFFAOYSA-N6-Hydroxy-2-(4-Hydroxyphenyl)-3-(4-[1-Ethylpiperidin-4-oxy]benzoyl)benzo[b]thiophene

Database identifiers

PubChem CID
9847697

Properties

Computed structural properties

XLogP
6.2
Topological polar surface area
98.2 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
6
Heavy atoms
34

Related reactions

1 records
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Compound notes

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