Basic information
- Standard SMILES
N#Cc1c(Cl)ncc2c1-c1ccccc1C(c1ccc(Cl)c(Cl)c1)C2- InChIKey
QAKQQAPZBIGARC-UHFFFAOYSA-N- Molecular formula
- C20H11Cl3N2
- Average molar mass
- 385.7 g/mol
Names & identifiers
- Preferred name
- 2-Chloro-6-(3,4-dichlorophenyl)-5,6-dihydrobenzo[f]isoquinoline-1-carbonitrile
- IUPAC
- 2-chloro-6-(3,4-dichlorophenyl)-5,6-dihydrobenzo[f]isoquinoline-1-carbonitrile
Names & synonyms
SCHEMBL2804014QAKQQAPZBIGARC-UHFFFAOYSA-N2-chloro-6-(3,4-dichlorophenyl)-5,6-dihydrobenzo[f]isoquinoline-1-carbonitrile
Database identifiers
- PubChem CID
- 86645586
Properties
Computed structural properties
- XLogP
- 6.2
- Topological polar surface area
- 36.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 532
Related reactions
2 records
Compound notes
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