6-(2-chloro-5-methylphenoxy)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid

C13H9ClN2O3S — CID 43475907

IUPAC6-(2-chloro-5-methylphenoxy)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid
SMILESCc1ccc(Cl)c(Oc2nc3sccn3c2C(=O)O)c1
InChIInChI=1S/C13H9ClN2O3S/c1-7-2-3-8(14)9(6-7)19-11-10(12(17)18)16-4-5-20-13(16)15-11/h2-6H,1H3,(H,17,18)
InChIKeySOZFDQQNAHPIAX-UHFFFAOYSA-N
MW308.75 g/mol
LogP3.85
Rot. Bonds3

About 6-(2-chloro-5-methylphenoxy)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid

6-(2-chloro-5-methylphenoxy)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid (PubChem CID 43475907) has the molecular formula C13H9ClN2O3S and a molecular weight of 308.75 g/mol. Its IUPAC name is 6-(2-chloro-5-methylphenoxy)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid.

Molecular Properties

Compound Name6-(2-chloro-5-methylphenoxy)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid
PubChem CID43475907
Molecular FormulaC13H9ClN2O3S
Molecular Weight308.75 g/mol
Exact Mass308.00
IUPAC Name6-(2-chloro-5-methylphenoxy)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid
SMILESCc1ccc(Cl)c(Oc2nc3sccn3c2C(=O)O)c1
InChIInChI=1S/C13H9ClN2O3S/c1-7-2-3-8(14)9(6-7)19-11-10(12(17)18)16-4-5-20-13(16)15-11/h2-6H,1H3,(H,17,18)
InChIKeySOZFDQQNAHPIAX-UHFFFAOYSA-N
XLogP3.85
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.75
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-(2-chloro-5-methylphenoxy)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-phenoxyimidazo[2,1-b][1,3]thiazole-5-carboxylic acid
CID 43475881
6-(4-bromophenoxy)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid
CID 43475866
5-chloro-6-(2-chloro-5-methylphenoxy)pyridine-3-carboxylic acid
CID 43364384
6-(4-cyanophenoxy)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid
CID 43475883
6-(3-bromo-4-fluorophenoxy)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid
CID 83234799
6-chloro-2-(2-chloro-5-methylphenoxy)pyridine-3-carboxylic acid
CID 55183255
5-(chloromethyl)-6-(2,4,5-trichlorophenoxy)imidazo[2,1-b][1,3]thiazole
CID 43476068
[6-(2,4-dimethylphenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanol
CID 43476093
5-(bromomethyl)-6-(2,4,5-trichlorophenoxy)imidazo[2,1-b][1,3]thiazole
CID 107086431
6-(1-propylpyrazol-4-yl)oxyimidazo[2,1-b][1,3]thiazole-5-carboxylic acid
CID 116801912
3-(2-chloro-5-methylphenoxy)pyridazine-4-carboxylic acid
CID 80516980
6-(4-bromo-2,5-dichlorophenoxy)imidazo[2,1-b][1,3]thiazole-5-carbaldehyde
CID 107658896

Frequently Asked Questions

What is the IUPAC name of 6-(2-chloro-5-methylphenoxy)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid?
The IUPAC name of 6-(2-chloro-5-methylphenoxy)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid (CID 43475907) is 6-(2-chloro-5-methylphenoxy)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid.
What is the SMILES notation for 6-(2-chloro-5-methylphenoxy)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid?
The canonical SMILES for 6-(2-chloro-5-methylphenoxy)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid is Cc1ccc(Cl)c(Oc2nc3sccn3c2C(=O)O)c1.
What is the InChIKey of 6-(2-chloro-5-methylphenoxy)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid?
The InChIKey is SOZFDQQNAHPIAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9ClN2O3S/c1-7-2-3-8(14)9(6-7)19-11-10(12(17)18)16-4-5-20-13(16)15-11/h2-6H,1H3,(H,17,18).
What are the key properties of 6-(2-chloro-5-methylphenoxy)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid?
6-(2-chloro-5-methylphenoxy)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid has a molecular weight of 308.75 g/mol, XLogP of 3.85, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-chloro-5-methylphenoxy)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid is sourced from PubChem (CID 43475907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).