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1-(5-(4-Fluoro-3,5-dimethoxyphenyl)furan-2-yl)-2-methoxy-2-(4-morpholinophenyl)ethanone

HCID 58432012
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
COc1cc(-c2ccc(C(=O)C(OC)c3ccc(N4CCOCC4)cc3)o2)cc(OC)c1F
InChIKey
NPMZPDCPBAKODJ-UHFFFAOYSA-N
Molecular formula
C25H26FNO6
Average molar mass
455.5 g/mol

Names & identifiers

Preferred name
1-(5-(4-Fluoro-3,5-dimethoxyphenyl)furan-2-yl)-2-methoxy-2-(4-morpholinophenyl)ethanone
IUPAC
1-[5-(4-fluoro-3,5-dimethoxyphenyl)furan-2-yl]-2-methoxy-2-(4-morpholin-4-ylphenyl)ethanone

Names & synonyms

SCHEMBL2385812NPMZPDCPBAKODJ-UHFFFAOYSA-N1-(5-(4-Fluoro-3,5-dimethoxyphenyl)furan-2-yl)-2-methoxy-2-(4-morpholinophenyl)ethanone

Database identifiers

PubChem CID
58432012

Properties

Computed structural properties

XLogP
4
Topological polar surface area
70.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
8
Heavy atoms
33
Formal charge
0
Complexity
610

Related reactions

5 records
New reaction record
HRID 56573 reaction equation
HRID 56573As productuspto-grants-2016_09
HRID 123153 reaction equation
HRID 123153As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 512672 reaction equation
HRID 512672As productuspto-grants-2015_08
HRID 1798641 reaction equation
HRID 1798641As productuspto-grants-2013_01
HRID 2359231 reaction equation
HRID 2359231As productuspto-grants-2014_04

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes