Basic information
- Standard SMILES
CC1CC(=Cc2ccc(Cl)c(Cl)c2)C(=O)N1S(=O)(=O)c1ccc(F)cc1- InChIKey
XGDVWGZETBHEFN-UHFFFAOYSA-N- Molecular formula
- C18H14Cl2FNO3S
- Average molar mass
- 414.3 g/mol
Names & identifiers
- Preferred name
- 3-(3,4-Dichlorophenylmethylene)-1-(4-fluorobenzenesulfonyl)-5-methyl-2-pyrrolidinone
- IUPAC
- 3-[(3,4-dichlorophenyl)methylidene]-1-(4-fluorophenyl)sulfonyl-5-methylpyrrolidin-2-one
Names & synonyms
SCHEMBL6784695XGDVWGZETBHEFN-UHFFFAOYSA-N3-(3,4-dichlorophenylmethylene)-1-(4-fluorobenzenesulfonyl)-5-methyl-2-pyrrolidinone
Database identifiers
- PubChem CID
- 69894596
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 62.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 670
Related reactions
1 records
Compound notes
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