1-[2-(4-Chlorophenyl)-5,8-dimethoxyquinolin-4-yl]-2-(dibutylamino)ethanol

HCID 285488

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Basic information

CAS: 69760-54-9
Standard SMILES: CCCCN(CCCC)CC(O)c1cc(-c2ccc(Cl)cc2)nc2c(OC)ccc(OC)c12
InChIKey: KPOILTSCJDYLEH-UHFFFAOYSA-N
Molecular formula: C27H35ClN2O3
Average molar mass: 471 g/mol
Monoisotopic mass: 470.2336207

Names & identifiers

Preferred name: 1-[2-(4-Chlorophenyl)-5,8-dimethoxyquinolin-4-yl]-2-(dibutylamino)ethanol
IUPAC: 1-[2-(4-chlorophenyl)-5,8-dimethoxyquinolin-4-yl]-2-(dibutylamino)ethanol

Names & synonyms

69760-54-91-[2-(4-chlorophenyl)-5,8-dimethoxyquinolin-4-yl]-2-(dibutylamino)ethanolNSC142468CHEMBL3229731DTXSID30301330NSC-1424681-[2-(4-Chlorophenyl)-5,8-dimethoxyquinolin-4-yl]-2-(dibutylamino)ethan-1-ol

Database identifiers

CAS: 69760-54-9
PubChem CID: 285488
DTXSID: DTXSID30301330
ChEMBL: CHEMBL3229731

Properties

Computed structural properties

XLogP: 6.1
Topological polar surface area: 54.8 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 5
Rotatable bonds: 12
Heavy atoms: 33
Formal charge: 0
Complexity: 537

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