Basic information
- Standard SMILES
O=C1CN(C(=O)c2ccc(F)c(Cl)c2Cl)CCN1- InChIKey
DYSNSSHIJAXALB-UHFFFAOYSA-N- Molecular formula
- C11H9Cl2FN2O2
- Average molar mass
- 291.1 g/mol
Names & identifiers
- Preferred name
- 4-[(2,3-Dichloro-4-fluorophenyl)carbonyl]-2-piperazinone
- IUPAC
- 4-(2,3-dichloro-4-fluorobenzoyl)piperazin-2-one
Names & synonyms
SCHEMBL109567DYSNSSHIJAXALB-UHFFFAOYSA-N4-[(2,3-Dichloro-4-fluorophenyl)carbonyl]-2-piperazinone
Database identifiers
- PubChem CID
- 66599335
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 49.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 356
Related reactions
7 records
Compound notes
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