Basic information
- Standard SMILES
CCC(CC)c1ccc(Cl)c2nc3n(c12)CCN3c1ccc(Cl)cc1C#N- InChIKey
YNVXNRSYUJZABU-UHFFFAOYSA-N- Molecular formula
- C21H20Cl2N4
- Average molar mass
- 399.3 g/mol
Names & identifiers
- Preferred name
- 5-Chloro-2-[8-chloro-5-(1-ethylpropyl)-2,3-dihydro-1H-imidazo[1,2-a]benzimidazol-1-yl]benzonitrile
- IUPAC
- 5-chloro-2-(5-chloro-8-pentan-3-yl-1,2-dihydroimidazo[1,2-a]benzimidazol-3-yl)benzonitrile
Names & synonyms
SCHEMBL3753969YNVXNRSYUJZABU-UHFFFAOYSA-N5-Chloro-2-[8-chloro-5-(1-ethylpropyl)-2,3-dihydro-1H-imidazo[1,2-a]benzimidazol-1-yl]benzonitrile
Database identifiers
- PubChem CID
- 57786166
Properties
Computed structural properties
- XLogP
- 6.3
- Topological polar surface area
- 44.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 574
Related reactions
4 records
Compound notes
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