6-Bromo-4-chloro-3-(4-fluorobenzyl)-2-methoxyquinoline

HCID 86715581

Notes Reactions

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Basic information

Standard SMILES: COc1nc2ccc(Br)cc2c(Cl)c1Cc1ccc(F)cc1
InChIKey: VCSGXRDMLRBCPL-UHFFFAOYSA-N
Molecular formula: C17H12BrClFNO
Average molar mass: 380.6 g/mol

Names & identifiers

Preferred name: 6-Bromo-4-chloro-3-(4-fluorobenzyl)-2-methoxyquinoline
IUPAC: 6-bromo-4-chloro-3-[(4-fluorophenyl)methyl]-2-methoxyquinoline

Names & synonyms

SCHEMBL15648578VCSGXRDMLRBCPL-UHFFFAOYSA-NDB-4147286-Bromo-4-chloro-3-(4-fluorobenzyl)-2-methoxyquinoline6-bromo-4-chloro-3-[(4-fluorophenyl)methyl]-2-methoxyquinoline1599528-94-5

Database identifiers

PubChem CID: 86715581

Properties

Computed structural properties

XLogP: 5.8
Topological polar surface area: 22.1 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 3
Heavy atoms: 22
Formal charge: 0
Complexity: 367

Related reactions

2 records

New reaction record

HRID 928717As productuspto-grants-2016_03

HRID 1507328As reactantuspto-grants-2015_12

Compound notes

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