5-bromo-4,8-dichloro-2-phenylquinoline

C15H8BrCl2N — CID 63408837

IUPAC5-bromo-4,8-dichloro-2-phenylquinoline
SMILESClc1ccc(Br)c2c(Cl)cc(-c3ccccc3)nc12
InChIInChI=1S/C15H8BrCl2N/c16-10-6-7-11(17)15-14(10)12(18)8-13(19-15)9-4-2-1-3-5-9/h1-8H
InChIKeySETKCTNRJYNQIE-UHFFFAOYSA-N
MW353.05 g/mol
LogP5.97
Rot. Bonds1

About 5-bromo-4,8-dichloro-2-phenylquinoline

5-bromo-4,8-dichloro-2-phenylquinoline (PubChem CID 63408837) has the molecular formula C15H8BrCl2N and a molecular weight of 353.05 g/mol. Its IUPAC name is 5-bromo-4,8-dichloro-2-phenylquinoline.

Molecular Properties

Compound Name5-bromo-4,8-dichloro-2-phenylquinoline
PubChem CID63408837
Molecular FormulaC15H8BrCl2N
Molecular Weight353.05 g/mol
Exact Mass350.92
IUPAC Name5-bromo-4,8-dichloro-2-phenylquinoline
SMILESClc1ccc(Br)c2c(Cl)cc(-c3ccccc3)nc12
InChIInChI=1S/C15H8BrCl2N/c16-10-6-7-11(17)15-14(10)12(18)8-13(19-15)9-4-2-1-3-5-9/h1-8H
InChIKeySETKCTNRJYNQIE-UHFFFAOYSA-N
XLogP5.97
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500353.05
LogP ≤ 55.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4,8-dichloro-5-fluoro-2-phenylquinoline
CID 107530938
5-bromo-4,8-dichloro-2-cyclopropylquinoline
CID 63408960
6-bromo-4,8-dichloro-2-phenylquinoline
CID 43668562
4-chloro-5,8-difluoro-2-phenylquinoline
CID 43668636
8-chloro-N,5-dimethyl-2-phenylquinolin-4-amine
CID 107628740
5-bromo-4-chloro-6-fluoro-8-methyl-2-phenylquinoline
CID 107593557
2-(3-bromo-4-chlorophenyl)-4-chloro-6-phenylpyrimidine
CID 115565748
(5-bromo-8-fluoro-2-phenylquinolin-4-yl)hydrazine
CID 63482610
6-bromo-8-chloro-2-phenylquinolin-4-amine
CID 55196336
4,6-dichloro-8-iodo-2-phenylquinoline
CID 107628258
4-chloro-7,8-dimethyl-2-phenylquinoline
CID 43668735
4-chloro-2-phenyl-[1]benzothiolo[3,2-b]pyridine
CID 90196949

Frequently Asked Questions

What is the IUPAC name of 5-bromo-4,8-dichloro-2-phenylquinoline?
The IUPAC name of 5-bromo-4,8-dichloro-2-phenylquinoline (CID 63408837) is 5-bromo-4,8-dichloro-2-phenylquinoline.
What is the SMILES notation for 5-bromo-4,8-dichloro-2-phenylquinoline?
The canonical SMILES for 5-bromo-4,8-dichloro-2-phenylquinoline is Clc1ccc(Br)c2c(Cl)cc(-c3ccccc3)nc12.
What is the InChIKey of 5-bromo-4,8-dichloro-2-phenylquinoline?
The InChIKey is SETKCTNRJYNQIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H8BrCl2N/c16-10-6-7-11(17)15-14(10)12(18)8-13(19-15)9-4-2-1-3-5-9/h1-8H.
What are the key properties of 5-bromo-4,8-dichloro-2-phenylquinoline?
5-bromo-4,8-dichloro-2-phenylquinoline has a molecular weight of 353.05 g/mol, XLogP of 5.97, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-4,8-dichloro-2-phenylquinoline is sourced from PubChem (CID 63408837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).