4-[[2,5-Dimethoxy-4-(1-pyrrolidinyl)phenyl]methylene]-N-(4-methylphenyl)-2,5-dioxo-1-imidazolidineacetamide
Basic information
- CAS
593274-98-7- Standard SMILES
COc1cc(N2CCCC2)c(OC)cc1C=C1NC(=O)N(CC(=O)Nc2ccc(C)cc2)C1=O- InChIKey
ROJAQCMVNCQIQK-UHFFFAOYSA-N- Molecular formula
- C25H28N4O5
- Average molar mass
- 464.5 g/mol
- Monoisotopic mass
- 464.20597001
Names & identifiers
- Preferred name
- 4-[[2,5-Dimethoxy-4-(1-pyrrolidinyl)phenyl]methylene]-N-(4-methylphenyl)-2,5-dioxo-1-imidazolidineacetamide
- IUPAC
- 2-[4-[(2,5-dimethoxy-4-pyrrolidin-1-ylphenyl)methylidene]-2,5-dioxoimidazolidin-1-yl]-N-(4-methylphenyl)acetamide
- English name
- 2-{4-[2,5-dimethoxy-4-(1-pyrrolidinyl)benzylidene]-2,5-dioxo-1-imidazolidinyl}-N-(4-methylphenyl)acetamide
- Molecular formula
- C25H28N4O5
- Molecular weight
- 464.51
Names & synonyms
DTXSID8011099264-[[2,5-Dimethoxy-4-(1-pyrrolidinyl)phenyl]methylene]-N-(4-methylphenyl)-2,5-dioxo-1-imidazolidineacetamide593274-98-72-[(4E)-4-{[2,5-DIMETHOXY-4-(PYRROLIDIN-1-YL)PHENYL]METHYLIDENE}-2,5-DIOXOIMIDAZOLIDIN-1-YL]-N-(4-METHYLPHENYL)ACETAMIDE2-{4-[2,5-dimethoxy-4-(1-pyrrolidinyl)benzylidene]-2,5-dioxo-1-imidazolidinyl}-N-(4-methylphenyl)acetamide1-Imidazolidineacetamide, 4-[[2,5-dimethoxy-4-(1-pyrrolidinyl)phenyl]methylene]-N-(4-methylphenyl)-2,5-dioxo-2-{(4Z)-4-[2,5-dimethoxy-4-(pyrrolidin-1-yl)benzylidene]-2,5-dioxoimidazolidin-1-yl}-N-(4-methylphenyl)acetamide
Database identifiers
- CAS
593274-98-7- PubChem CID
- 3499263
- DTXSID
DTXSID801109926
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 100 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 788
Physicochemical properties
- Density
- 1.312 · 1.312±0.06 g/cm3(Predicted)
- pka
- 8.8 · 8.80±0.20(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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