1-[7-Chloro-2-(4-chlorophenyl)quinolin-3-yl]-2-(dibutylamino)ethanol

HCID 423786

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Basic information

CAS: 31589-03-4
Standard SMILES: CCCCN(CCCC)CC(O)c1cc2ccc(Cl)cc2nc1-c1ccc(Cl)cc1
InChIKey: PREZAHYIZDKGJR-UHFFFAOYSA-N
Molecular formula: C25H30Cl2N2O
Average molar mass: 445.4 g/mol
Monoisotopic mass: 444.173519

Names & identifiers

Preferred name: 1-[7-Chloro-2-(4-chlorophenyl)quinolin-3-yl]-2-(dibutylamino)ethanol
IUPAC: 1-[7-chloro-2-(4-chlorophenyl)quinolin-3-yl]-2-(dibutylamino)ethanol

Names & synonyms

31589-03-4NSC1575701-[7-chloro-2-(4-chlorophenyl)quinolin-3-yl]-2-(dibutylamino)ethanolCHEMBL3230153DTXSID80329781NSC-1575701-[7-Chloro-2-(4-chlorophenyl)quinolin-3-yl]-2-(dibutylamino)ethan-1-ol

Database identifiers

CAS: 31589-03-4
PubChem CID: 423786
DTXSID: DTXSID80329781
ChEMBL: CHEMBL3230153

Properties

Computed structural properties

XLogP: 6.8
Topological polar surface area: 36.4 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 10
Heavy atoms: 30
Formal charge: 0
Complexity: 478

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