HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Compound

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

HCID 57719197
New noteNew reactionRequest quotes
Print preview

Completing data — refresh the page later to see the latest

Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
COc1ccc(CN2CC(CCOc3ccc(OC(C)(C)C(=O)O)cc3)N(C)C2=O)cc1
InChIKey
BXUZCGYLYVJGLC-UHFFFAOYSA-N
Molecular formula
C24H30N2O6
Average molar mass
442.5 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
IUPAC
2-[4-[2-[1-[(4-methoxyphenyl)methyl]-3-methyl-2-oxoimidazolidin-4-yl]ethoxy]phenoxy]-2-methylpropanoic acid

Names & synonyms

SCHEMBL3996220BXUZCGYLYVJGLC-UHFFFAOYSA-N2-(4-{2-[1-(4-methoxy-benzyl)-3-methyl-2-oxo- imidazolidin-4-yl]-ethoxy}-phenoxy)-2-methyl-propionic acid2-(4-{2-[1-(4-methoxy-benzyl)-3-methyl-2-oxo-imidazolidin-4-yl]-ethoxy}-phenoxy)-2-methyl-propionic acid

Database identifiers

PubChem CID
57719197

Properties

Computed structural propertiesFilling in

XLogP
3.2
Topological polar surface area
88.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
10
Heavy atoms
32
Formal charge
0
Complexity
626

Related reactions

2 records
New reaction record
HRID 175212 reaction equation
HRID 175212As productTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 1985233 reaction equation
HRID 1985233As productuspto-grants-2009_06

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes
More actions
New noteNew reactionRequest quotes