Basic information
- Standard SMILES
O=C1NCCN(N=Cc2ccc(Cl)o2)C1=O- InChIKey
LKAIYJAXAZIDLK-UHFFFAOYSA-N- Molecular formula
- C9H8ClN3O3
- Average molar mass
- 241.63 g/mol
Names & identifiers
- Preferred name
- 1-(5-Chloro-furfurylidene-amino)-2,3-dioxo-piperazine
- IUPAC
- 1-[(5-chlorofuran-2-yl)methylideneamino]piperazine-2,3-dione
Names & synonyms
SCHEMBL11477449LKAIYJAXAZIDLK-UHFFFAOYSA-N1-(5-chloro-furfurylidene-amino)-2,3-dioxo-piperazine
Database identifiers
- PubChem CID
- 54037539
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 74.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 334
Related reactions
2 records
Compound notes
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