2-(2-ethoxyphenyl)imidazo[2,1-b][1,3]benzothiazole

C17H14N2OS — CID 19209602

IUPAC2-(2-ethoxyphenyl)imidazo[2,1-b][1,3]benzothiazole
SMILESCCOc1ccccc1-c1cn2c(n1)sc1ccccc12
InChIInChI=1S/C17H14N2OS/c1-2-20-15-9-5-3-7-12(15)13-11-19-14-8-4-6-10-16(14)21-17(19)18-13/h3-11H,2H2,1H3
InChIKeyFQFOACHQHNGHFI-UHFFFAOYSA-N
MW294.38 g/mol
LogP4.61
Rot. Bonds3

About 2-(2-ethoxyphenyl)imidazo[2,1-b][1,3]benzothiazole

2-(2-ethoxyphenyl)imidazo[2,1-b][1,3]benzothiazole (PubChem CID 19209602) has the molecular formula C17H14N2OS and a molecular weight of 294.38 g/mol. Its IUPAC name is 2-(2-ethoxyphenyl)imidazo[2,1-b][1,3]benzothiazole.

Molecular Properties

Compound Name2-(2-ethoxyphenyl)imidazo[2,1-b][1,3]benzothiazole
PubChem CID19209602
Molecular FormulaC17H14N2OS
Molecular Weight294.38 g/mol
Exact Mass294.08
IUPAC Name2-(2-ethoxyphenyl)imidazo[2,1-b][1,3]benzothiazole
SMILESCCOc1ccccc1-c1cn2c(n1)sc1ccccc12
InChIInChI=1S/C17H14N2OS/c1-2-20-15-9-5-3-7-12(15)13-11-19-14-8-4-6-10-16(14)21-17(19)18-13/h3-11H,2H2,1H3
InChIKeyFQFOACHQHNGHFI-UHFFFAOYSA-N
XLogP4.61
TPSA26.53 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.38
LogP ≤ 54.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-ethoxy-2-(2-methoxyphenyl)imidazo[2,1-b][1,3]benzothiazole
CID 19209658
2-(2-ethoxyphenyl)-7,8-dimethylimidazo[2,1-b][1,3]benzothiazole
CID 19209742
6-(2-ethoxyphenyl)-2-pentylimidazo[2,1-b][1,3,4]thiadiazole
CID 23608896
8-ethoxy-3-(6-methylimidazo[2,1-b][1,3]benzothiazol-2-yl)chromen-2-one
CID 4066054
2-(2-ethoxyphenyl)-5-methylimidazo[1,2-a]pyridine-6-carbonitrile
CID 82060848
2-(2-ethoxyphenyl)-5-methylimidazo[1,2-a]pyridine;hydroiodide
CID 19214751
ethyl 2-[6-(2-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetate
CID 19224615
2-(4-chlorophenyl)imidazo[2,1-b][1,3]benzothiazole
CID 667714
2-(2,4-dimethylphenyl)-6-ethoxyimidazo[2,1-b][1,3]benzothiazole
CID 19209821
6-butyl-2-(2-chlorophenyl)imidazo[2,1-b][1,3]benzothiazole
CID 19209863
2-imidazo[2,1-b][1,3]benzothiazol-2-yl-4,4-dimethyl-5H-1,3-oxazole
CID 14067638
methyl imidazo[2,1-b][1,3]benzothiazole-2-carboxylate
CID 14067629

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxyphenyl)imidazo[2,1-b][1,3]benzothiazole?
The IUPAC name of 2-(2-ethoxyphenyl)imidazo[2,1-b][1,3]benzothiazole (CID 19209602) is 2-(2-ethoxyphenyl)imidazo[2,1-b][1,3]benzothiazole.
What is the SMILES notation for 2-(2-ethoxyphenyl)imidazo[2,1-b][1,3]benzothiazole?
The canonical SMILES for 2-(2-ethoxyphenyl)imidazo[2,1-b][1,3]benzothiazole is CCOc1ccccc1-c1cn2c(n1)sc1ccccc12.
What is the InChIKey of 2-(2-ethoxyphenyl)imidazo[2,1-b][1,3]benzothiazole?
The InChIKey is FQFOACHQHNGHFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2OS/c1-2-20-15-9-5-3-7-12(15)13-11-19-14-8-4-6-10-16(14)21-17(19)18-13/h3-11H,2H2,1H3.
What are the key properties of 2-(2-ethoxyphenyl)imidazo[2,1-b][1,3]benzothiazole?
2-(2-ethoxyphenyl)imidazo[2,1-b][1,3]benzothiazole has a molecular weight of 294.38 g/mol, XLogP of 4.61, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxyphenyl)imidazo[2,1-b][1,3]benzothiazole is sourced from PubChem (CID 19209602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).