4(3H)-Quinazolinone, 3-(4-((3,4-dimethoxyphenyl)methylene)-4,5-dihydro-2-methyl-5-oxo-1H-imidazol-1-yl)-2-ethyl-6-iodo-
Basic information
- CAS
114496-31-0- Standard SMILES
CCc1nc2ccc(I)cc2c(=O)n1N1C(=O)/C(=C/c2ccc(OC)c(OC)c2)N=C1C- InChIKey
ISUOUZIJAWOFAM-ZDLGFXPLSA-N- Molecular formula
- C23H21IN4O4
- Average molar mass
- 544.3 g/mol
- Monoisotopic mass
- 544.06075
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 3-(4-((3,4-dimethoxyphenyl)methylene)-4,5-dihydro-2-methyl-5-oxo-1H-imidazol-1-yl)-2-ethyl-6-iodo-
- IUPAC
- 3-[(4Z)-4-[(3,4-dimethoxyphenyl)methylidene]-2-methyl-5-oxoimidazol-1-yl]-2-ethyl-6-iodoquinazolin-4-one
Names & synonyms
114496-31-04(3H)-Quinazolinone, 3-(4-((3,4-dimethoxyphenyl)methylene)-4,5-dihydro-2-methyl-5-oxo-1H-imidazol-1-yl)-2-ethyl-6-iodo-RefChem:1069139
Database identifiers
- CAS
114496-31-0- PubChem CID
- 6435964
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 83.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 857
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Compound notes
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