Basic information
- Standard SMILES
Cc1cc(C)c(/C=C2\C(=O)N(C(=O)n3cc(F)c(=O)[nH]c3=O)c3ccccc32)[nH]1- InChIKey
REFMUCXPWOWCSC-JYRVWZFOSA-N- Molecular formula
- C20H15FN4O4
- Average molar mass
- 394.4 g/mol
- Monoisotopic mass
- 394.10773313
Names & identifiers
- Preferred name
- 1-{3-[1-(3,5-Dimethyl-1h-pyrrol-2-yl)-meth-(z)-ylidene]-2-oxo-2,3-dihydro-indole-1-carbonyl}-5-fluoro-1h-pyrimidine-2,4-dione
- IUPAC
- 1-[(3Z)-3-[(3,5-dimethyl-1H-pyrrol-2-yl)methylidene]-2-oxoindole-1-carbonyl]-5-fluoropyrimidine-2,4-dione
Names & synonyms
SCHEMBL5878549REFMUCXPWOWCSC-JYRVWZFOSA-N1-{3-[1-(3,5-dimethyl-1h-pyrrol-2-yl)-meth-(z)-ylidene]-2-oxo-2,3-dihydro-indole-1-carbonyl}-5-fluoro-1h-pyrimidine-2,4-dione
Database identifiers
- PubChem CID
- 60111233
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 103 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 838
Related reactions
2 records
Compound notes
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