Basic information
- Standard SMILES
CC(C)C(C(=O)O)N1CCN(Cc2ccc(OCc3ccncc3)cc2)C1=O- InChIKey
NDUOLQLWKQHNKG-UHFFFAOYSA-N- Molecular formula
- C21H25N3O4
- Average molar mass
- 383.4 g/mol
Names & identifiers
- Preferred name
- 3-Methyl-2-{2-oxo-3-(4-(pyridin-4-ylmethoxy)benzyl)imidazolidin-1-yl}-butyric acid
- IUPAC
- 3-methyl-2-[2-oxo-3-[[4-(pyridin-4-ylmethoxy)phenyl]methyl]imidazolidin-1-yl]butanoic acid
Names & synonyms
SCHEMBL3179070NDUOLQLWKQHNKG-UHFFFAOYSA-N3-methyl-2-{2-oxo-3-(4-(pyridin-4-ylmethoxy)benzyl)imidazolidin-1-yl}-butyric acid
Database identifiers
- PubChem CID
- 68539655
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 83 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 528
Related reactions
2 records
Compound notes
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