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[1-(4-Methoxy-benzyl)-2,5-dioxo-imidazolidin-4-yl]-acetic acid methyl ester

HCID 57718915
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
COC(=O)CC1NC(=O)N(Cc2ccc(OC)cc2)C1=O
InChIKey
LWTGPJAIPDKPLN-UHFFFAOYSA-N
Molecular formula
C14H16N2O5
Average molar mass
292.29 g/mol

Names & identifiers

Preferred name
[1-(4-Methoxy-benzyl)-2,5-dioxo-imidazolidin-4-yl]-acetic acid methyl ester
IUPAC
methyl 2-[1-[(4-methoxyphenyl)methyl]-2,5-dioxoimidazolidin-4-yl]acetate

Names & synonyms

SCHEMBL3991035LWTGPJAIPDKPLN-UHFFFAOYSA-N[1-(4-Methoxy-benzyl)-2,5-dioxo-imidazolidin-4-yl]-acetic acid methyl ester

Database identifiers

PubChem CID
57718915

Properties

Computed structural properties

XLogP
0.5
Topological polar surface area
84.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
21
Formal charge
0
Complexity
418

Related reactions

4 records
New reaction record
HRID 1560064 reaction equation
HRID 1560064As reactantTraining data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID 1561166 reaction equation
HRID 1561166As productTraining data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID 1985115 reaction equation
HRID 1985115As productuspto-grants-2009_06
HRID 1985116 reaction equation
HRID 1985116As reactantuspto-grants-2009_06

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes