8-bromo-5-chloroimidazo[1,2-a]quinoline-2-carboxylic acid

C12H6BrClN2O2 — CID 12763985

IUPAC8-bromo-5-chloroimidazo[1,2-a]quinoline-2-carboxylic acid
SMILESO=C(O)c1cn2c(cc(Cl)c3ccc(Br)cc32)n1
InChIInChI=1S/C12H6BrClN2O2/c13-6-1-2-7-8(14)4-11-15-9(12(17)18)5-16(11)10(7)3-6/h1-5H,(H,17,18)
InChIKeyJWTBCVUMWAOWGF-UHFFFAOYSA-N
MW325.55 g/mol
LogP3.60
Rot. Bonds1

About 8-bromo-5-chloroimidazo[1,2-a]quinoline-2-carboxylic acid

8-bromo-5-chloroimidazo[1,2-a]quinoline-2-carboxylic acid (PubChem CID 12763985) has the molecular formula C12H6BrClN2O2 and a molecular weight of 325.55 g/mol. Its IUPAC name is 8-bromo-5-chloroimidazo[1,2-a]quinoline-2-carboxylic acid.

Molecular Properties

Compound Name8-bromo-5-chloroimidazo[1,2-a]quinoline-2-carboxylic acid
PubChem CID12763985
Molecular FormulaC12H6BrClN2O2
Molecular Weight325.55 g/mol
Exact Mass323.93
IUPAC Name8-bromo-5-chloroimidazo[1,2-a]quinoline-2-carboxylic acid
SMILESO=C(O)c1cn2c(cc(Cl)c3ccc(Br)cc32)n1
InChIInChI=1S/C12H6BrClN2O2/c13-6-1-2-7-8(14)4-11-15-9(12(17)18)5-16(11)10(7)3-6/h1-5H,(H,17,18)
InChIKeyJWTBCVUMWAOWGF-UHFFFAOYSA-N
XLogP3.60
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.55
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-Bromo-8-methylimidazo[1,2-a]pyridine-2-carboxylic acid
CID 5260648
Ethyl 8-chloroimidazo-[1,2-a]-quinoline-2-carboxylate
CID 12763958
8-Chloroimidazo-[1,2-a]-quinoline-2-carboxylic acid
CID 12763959
Ethyl 5-chloroimidazo[1,2-a]quinoline-2-carboxylate
CID 12763962
5,8-Dichloroimidazo-[1,2-a]-quinoline-2-carboxylic acid
CID 12763975
Ethyl 5,8-dichloroimidazo-[1,2-a]-quinoline-2-carboxylate
CID 12763976
7-Chloroimidazo[1,2-a]quinoline-2-carboxylic acid
CID 12763977
5-Bromoimidazo-[1,2-a]-quinoline-2-carboxylic acid
CID 12763979
6-Chloroimidazo[1,2-a]quinoline-2-carboxylic acid
CID 12763983
Imidazo-[1,2-a]-quinoline-2-carboxylic acid
CID 12763992
5-Chloroimidazo-[1,2-a]-quinoline-2-carboxylic acid hydrochloride
CID 45263932
Imidazo1,2-aquinoline-2-carboxylic acid, 8-bromo-5-chloro-, ethyl ester
CID 12763986

Frequently Asked Questions

What is the IUPAC name of 8-bromo-5-chloroimidazo[1,2-a]quinoline-2-carboxylic acid?
The IUPAC name of 8-bromo-5-chloroimidazo[1,2-a]quinoline-2-carboxylic acid (CID 12763985) is 8-bromo-5-chloroimidazo[1,2-a]quinoline-2-carboxylic acid.
What is the SMILES notation for 8-bromo-5-chloroimidazo[1,2-a]quinoline-2-carboxylic acid?
The canonical SMILES for 8-bromo-5-chloroimidazo[1,2-a]quinoline-2-carboxylic acid is O=C(O)c1cn2c(cc(Cl)c3ccc(Br)cc32)n1.
What is the InChIKey of 8-bromo-5-chloroimidazo[1,2-a]quinoline-2-carboxylic acid?
The InChIKey is JWTBCVUMWAOWGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H6BrClN2O2/c13-6-1-2-7-8(14)4-11-15-9(12(17)18)5-16(11)10(7)3-6/h1-5H,(H,17,18).
What are the key properties of 8-bromo-5-chloroimidazo[1,2-a]quinoline-2-carboxylic acid?
8-bromo-5-chloroimidazo[1,2-a]quinoline-2-carboxylic acid has a molecular weight of 325.55 g/mol, XLogP of 3.60, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-bromo-5-chloroimidazo[1,2-a]quinoline-2-carboxylic acid is sourced from PubChem (CID 12763985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).