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

HCID 10195684
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)cc1C
InChIKey
FDGIIHIHSVHYJD-UHFFFAOYSA-N
Molecular formula
C27H36N2O6
Average molar mass
484.6 g/mol

Names & identifiers

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

Names & synonyms

SCHEMBL3993897FDGIIHIHSVHYJD-UHFFFAOYSA-N2-(4-{2-[1-(4-Methoxy-benzyl)-3-methyl-2-oxo-imidazolidin-4-yl]-ethoxy}-2-methyl-phenoxy)-2-methyl-propionic acid ethyl ester

Database identifiers

PubChem CID
10195684

Properties

Computed structural properties

XLogP
4.3
Topological polar surface area
77.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
12
Heavy atoms
35
Formal charge
0
Complexity
693

Related reactions

4 records
New reaction record
HRID 211834 reaction equation
HRID 211834As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 677766 reaction equation
HRID 677766As productTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 1985117 reaction equation
HRID 1985117As productuspto-grants-2009_06
HRID 1985118 reaction equation
HRID 1985118As reactantuspto-grants-2009_06

Compound notes

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