ethyl 2-[6-(2-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetate

C17H18N2O3S — CID 19224615

IUPACethyl 2-[6-(2-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetate
SMILESCCOC(=O)Cc1csc2nc(-c3ccccc3OCC)cn12
InChIInChI=1S/C17H18N2O3S/c1-3-21-15-8-6-5-7-13(15)14-10-19-12(9-16(20)22-4-2)11-23-17(19)18-14/h5-8,10-11H,3-4,9H2,1-2H3
InChIKeyHTCGKEVRMZIRLM-UHFFFAOYSA-N
MW330.41 g/mol
LogP3.57
Rot. Bonds6

About ethyl 2-[6-(2-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetate

ethyl 2-[6-(2-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetate (PubChem CID 19224615) has the molecular formula C17H18N2O3S and a molecular weight of 330.41 g/mol. Its IUPAC name is ethyl 2-[6-(2-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetate.

Molecular Properties

Compound Nameethyl 2-[6-(2-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetate
PubChem CID19224615
Molecular FormulaC17H18N2O3S
Molecular Weight330.41 g/mol
Exact Mass330.10
IUPAC Nameethyl 2-[6-(2-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetate
SMILESCCOC(=O)Cc1csc2nc(-c3ccccc3OCC)cn12
InChIInChI=1S/C17H18N2O3S/c1-3-21-15-8-6-5-7-13(15)14-10-19-12(9-16(20)22-4-2)11-23-17(19)18-14/h5-8,10-11H,3-4,9H2,1-2H3
InChIKeyHTCGKEVRMZIRLM-UHFFFAOYSA-N
XLogP3.57
TPSA52.83 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.41
LogP ≤ 53.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

ethyl 2-[6-(furan-2-yl)imidazo[2,1-b][1,3]thiazol-3-yl]acetate
CID 43464958
ethyl 2-[6-(3-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetate
CID 43464947
ethyl 3-[2-(2-ethoxyphenyl)-1,3-thiazol-4-yl]propanoate
CID 103485086
ethyl 2-[2-(2-amino-1,3-thiazol-4-yl)phenoxy]acetate;hydrobromide
CID 56832420
2-(2-ethoxyphenyl)imidazo[2,1-b][1,3]benzothiazole
CID 19209602
2-[6-(2-bromophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetic acid
CID 43464903
2-(2-ethoxyphenyl)-7,8-dimethylimidazo[2,1-b][1,3]benzothiazole
CID 19209742
ethyl 2-[2-(2-methoxyphenyl)-1,3-thiazol-4-yl]acetate
CID 15336769
2-[6-(4-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-ethyl-N-phenylacetamide
CID 121038352
2-[6-(4-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-methylacetamide
CID 40509194
ethyl 4-[cyclopropyl-[2-(6-phenylimidazo[2,1-b][1,3]thiazol-3-yl)ethyl]amino]-4-oxobutanoate
CID 42788752
2-(2-ethoxyphenyl)-5-methylimidazo[1,2-a]pyridine;hydroiodide
CID 19214751

Frequently Asked Questions

What is the IUPAC name of ethyl 2-[6-(2-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetate?
The IUPAC name of ethyl 2-[6-(2-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetate (CID 19224615) is ethyl 2-[6-(2-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetate.
What is the SMILES notation for ethyl 2-[6-(2-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetate?
The canonical SMILES for ethyl 2-[6-(2-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetate is CCOC(=O)Cc1csc2nc(-c3ccccc3OCC)cn12.
What is the InChIKey of ethyl 2-[6-(2-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetate?
The InChIKey is HTCGKEVRMZIRLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O3S/c1-3-21-15-8-6-5-7-13(15)14-10-19-12(9-16(20)22-4-2)11-23-17(19)18-14/h5-8,10-11H,3-4,9H2,1-2H3.
What are the key properties of ethyl 2-[6-(2-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetate?
ethyl 2-[6-(2-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetate has a molecular weight of 330.41 g/mol, XLogP of 3.57, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[6-(2-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetate is sourced from PubChem (CID 19224615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).