5-[[5-(2,3-Dichlorophenyl)furan-2-yl]methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione
Basic information
- CAS
333770-98-2- Standard SMILES
CN1C(=O)C(=Cc2ccc(-c3cccc(Cl)c3Cl)o2)C(=O)N(C)C1=O- InChIKey
RZJJBJDFCOBDRO-UHFFFAOYSA-N- Molecular formula
- C17H12Cl2N2O4
- Average molar mass
- 379.2 g/mol
- Monoisotopic mass
- 378.0174123
Names & identifiers
- Preferred name
- 5-[[5-(2,3-Dichlorophenyl)furan-2-yl]methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione
- IUPAC
- 5-[[5-(2,3-dichlorophenyl)furan-2-yl]methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione
- English name
- 5-{[5-(2,3-dichlorophenyl)-2-furyl]methylene}-1,3-dimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione
- Molecular formula
- C17H12Cl2N2O4
- Molecular weight
- 379.19
Names & synonyms
5-[[5-(2,3-dichlorophenyl)furan-2-yl]methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione5-{[5-(2,3-dichlorophenyl)-2-furyl]methylene}-1,3-dimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione5-{[5-(2,3-DICHLOROPHENYL)FURAN-2-YL]METHYLIDENE}-1,3-DIMETHYL-1,3-DIAZINANE-2,4,6-TRIONECBMicro_036154STK174987AKOS000325736BIM-0036134.P0015-((5-(2,3-dichlorophenyl)furan-2-yl)methylene)-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione5-{[5-(2,3-dichlorophenyl)furan-2-yl]methylidene}-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-[[5-(2,3-dichlorophenyl)-2-furanyl]methylene]-1,3-dimethyl-
Database identifiers
- CAS
333770-98-2- PubChem CID
- 2199545
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 70.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 598
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