2-[(4-Chloroanilino)methylidene]-1-oxo-3-phenylpyrido[1,2-a]benzimidazole-4-carbonitrile
Basic information
- Standard SMILES
N#Cc1c(-c2ccccc2)c(=CNc2ccc(Cl)cc2)c(=O)n2c1nc1ccccc12- InChIKey
ASQOGSDRLKHILK-UHFFFAOYSA-N- Molecular formula
- C25H15ClN4O
- Average molar mass
- 422.9 g/mol
- Monoisotopic mass
- 422.0934388
Names & identifiers
- Preferred name
- 2-[(4-Chloroanilino)methylidene]-1-oxo-3-phenylpyrido[1,2-a]benzimidazole-4-carbonitrile
- IUPAC
- 2-[(4-chloroanilino)methylidene]-1-oxo-3-phenylpyrido[1,2-a]benzimidazole-4-carbonitrile
Database identifiers
- PubChem CID
- 395416
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 70.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 813
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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