4(3H)-Quinazolinone, 3-(4-((3,4-dimethoxyphenyl)methylene)-4,5-dihydro-2-methyl-5-oxo-1H-imidazol-1-yl)-6-iodo-2-methyl-
Basic information
- CAS
114496-25-2- Standard SMILES
COc1ccc(/C=C2\N=C(C)N(n3c(C)nc4ccc(I)cc4c3=O)C2=O)cc1OC- InChIKey
FZOGBZPQTZEKLE-NVMNQCDNSA-N- Molecular formula
- C22H19IN4O4
- Average molar mass
- 530.3 g/mol
- Monoisotopic mass
- 530.0451
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 3-(4-((3,4-dimethoxyphenyl)methylene)-4,5-dihydro-2-methyl-5-oxo-1H-imidazol-1-yl)-6-iodo-2-methyl-
- IUPAC
- 3-[(4Z)-4-[(3,4-dimethoxyphenyl)methylidene]-2-methyl-5-oxoimidazol-1-yl]-6-iodo-2-methylquinazolin-4-one
Names & synonyms
114496-25-24(3H)-Quinazolinone, 3-(4-((3,4-dimethoxyphenyl)methylene)-4,5-dihydro-2-methyl-5-oxo-1H-imidazol-1-yl)-6-iodo-2-methyl-RefChem:10691413-(4-(3,4-Dimethoxybenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-imidazol-1-yl)-6-iodo-2-methylquinazolin-4(3H)-one3-[(4Z)-4-[(3,4-dimethoxyphenyl)methylidene]-2-methyl-5-oxo-4,5-dihydro-1H-imidazol-1-yl]-6-iodo-2-methyl-3,4-dihydroquinazolin-4-one
Database identifiers
- CAS
114496-25-2- PubChem CID
- 6435962
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 83.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 841
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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