4-(4-bromophenoxy)-7-chloroquinoline

C15H9BrClNO — CID 4826148

IUPAC4-(4-bromophenoxy)-7-chloroquinoline
SMILESClc1ccc2c(Oc3ccc(Br)cc3)ccnc2c1
InChIInChI=1S/C15H9BrClNO/c16-10-1-4-12(5-2-10)19-15-7-8-18-14-9-11(17)3-6-13(14)15/h1-9H
InChIKeyUXJJPLKKACPOPY-UHFFFAOYSA-N
MW334.60 g/mol
LogP5.44
Rot. Bonds2

About 4-(4-bromophenoxy)-7-chloroquinoline

4-(4-bromophenoxy)-7-chloroquinoline (PubChem CID 4826148) has the molecular formula C15H9BrClNO and a molecular weight of 334.60 g/mol. Its IUPAC name is 4-(4-bromophenoxy)-7-chloroquinoline.

Molecular Properties

Compound Name4-(4-bromophenoxy)-7-chloroquinoline
PubChem CID4826148
Molecular FormulaC15H9BrClNO
Molecular Weight334.60 g/mol
Exact Mass332.96
IUPAC Name4-(4-bromophenoxy)-7-chloroquinoline
SMILESClc1ccc2c(Oc3ccc(Br)cc3)ccnc2c1
InChIInChI=1S/C15H9BrClNO/c16-10-1-4-12(5-2-10)19-15-7-8-18-14-9-11(17)3-6-13(14)15/h1-9H
InChIKeyUXJJPLKKACPOPY-UHFFFAOYSA-N
XLogP5.44
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500334.60
LogP ≤ 55.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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7-chloro-N-(4-ethoxyphenyl)-4-quinolinamine
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7-Chloro-4-(2-methoxyphenoxy)quinoline
CID 2442807
4-Chloro-7-(propan-2-yloxy)quinoline
CID 78324000
7-Chloro-4-methoxyquinoline
CID 1511030
1-Benzyl-7-chloro-4-hexoxyquinolin-1-ium bromide
CID 10433084
5-(7-chloroquinolin-4-yl)oxy-N,N-diethylpentan-1-amine
CID 24881538
4-(7-chloroquinolin-4-yl)oxy-N,N,N',N'-tetraethylheptane-1,7-diamine
CID 24881542
5-(7-chloroquinolin-4-yl)oxy-N,N,N',N'-tetraethylnonane-1,9-diamine
CID 24881607
4-Chloro-7-(3-phenylpropoxy)quinoline
CID 78324295
7-Chloro-4-(4-fluorophenoxy)quinoline
CID 164171
7-Chloro-4-ethoxyquinoline
CID 226888

Frequently Asked Questions

What is the IUPAC name of 4-(4-bromophenoxy)-7-chloroquinoline?
The IUPAC name of 4-(4-bromophenoxy)-7-chloroquinoline (CID 4826148) is 4-(4-bromophenoxy)-7-chloroquinoline.
What is the SMILES notation for 4-(4-bromophenoxy)-7-chloroquinoline?
The canonical SMILES for 4-(4-bromophenoxy)-7-chloroquinoline is Clc1ccc2c(Oc3ccc(Br)cc3)ccnc2c1.
What is the InChIKey of 4-(4-bromophenoxy)-7-chloroquinoline?
The InChIKey is UXJJPLKKACPOPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9BrClNO/c16-10-1-4-12(5-2-10)19-15-7-8-18-14-9-11(17)3-6-13(14)15/h1-9H.
What are the key properties of 4-(4-bromophenoxy)-7-chloroquinoline?
4-(4-bromophenoxy)-7-chloroquinoline has a molecular weight of 334.60 g/mol, XLogP of 5.44, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-bromophenoxy)-7-chloroquinoline is sourced from PubChem (CID 4826148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).