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2-(4-{2-[1-(4-Methoxy-benzyl)-3-methyl-2-oxo-imidazolidin-4-yl]-ethoxy}-phenoxy)-2-methyl-propionic acid ethyl ester

HCID 57718899
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CCOC(=O)C(C)(C)Oc1ccc(OCCC2CN(Cc3ccc(OC)cc3)C(=O)N2C)cc1
InChIKey
HLXMLPHZWJTWSS-UHFFFAOYSA-N
Molecular formula
C26H34N2O6
Average molar mass
470.6 g/mol

Names & identifiers

Preferred name
2-(4-{2-[1-(4-Methoxy-benzyl)-3-methyl-2-oxo-imidazolidin-4-yl]-ethoxy}-phenoxy)-2-methyl-propionic acid ethyl ester
IUPAC
ethyl 2-[4-[2-[1-[(4-methoxyphenyl)methyl]-3-methyl-2-oxoimidazolidin-4-yl]ethoxy]phenoxy]-2-methylpropanoate

Names & synonyms

SCHEMBL3989276HLXMLPHZWJTWSS-UHFFFAOYSA-N2-(4-{2-[1-(4-methoxy-benzyl)-3-methyl-2-oxo- imidazolidin-4-yl]-ethoxy}-phenoxy)-2-methyl-propionic acid ethyl ester2-(4-{2-[1-(4-methoxy-benzyl)-3-methyl-2-oxo-imidazolidin-4-yl]-ethoxy}-phenoxy)-2-methyl-propionic acid ethyl ester

Database identifiers

PubChem CID
57718899

Properties

Computed structural properties

XLogP
3.9
Topological polar surface area
77.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
12
Heavy atoms
34
Formal charge
0
Complexity
656

Related reactions

6 records
New reaction record
HRID 175212 reaction equation
HRID 175212As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 316250 reaction equation
HRID 316250As productTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 682911 reaction equation
HRID 682911As reactantTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 1985230 reaction equation
HRID 1985230As productuspto-grants-2009_06
HRID 1985231 reaction equation
HRID 1985231As reactantuspto-grants-2009_06
HRID 1985233 reaction equation
HRID 1985233As reactantuspto-grants-2009_06

Compound notes

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