Basic information
- Standard SMILES
O=C(c1cccnc1Oc1cc(Cl)ccc1Cl)N1CCCc2ccc(Cl)cc21- InChIKey
JGLKTQMOJUJMCD-UHFFFAOYSA-N- Molecular formula
- C21H15Cl3N2O2
- Average molar mass
- 433.7 g/mol
- Monoisotopic mass
- 432.019911
Names & identifiers
- Preferred name
- (7-Chloro-3,4-dihydro-2H-quinolin-1-yl)-[2-(2,5-dichloro-phenoxy)-pyridin-3-yl]-methanone
- IUPAC
- (7-chloro-3,4-dihydro-2H-quinolin-1-yl)-[2-(2,5-dichlorophenoxy)-3-pyridinyl]methanone
Names & synonyms
SCHEMBL2332835JGLKTQMOJUJMCD-UHFFFAOYSA-N(7-Chloro-3,4-dihydro-2H-quinolin-1-yl)-[2-(2,5-dichloro-phenoxy)-pyridin-3-yl]-methanone
Database identifiers
- PubChem CID
- 46194698
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 42.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 552
Related reactions
2 records
Compound notes
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