3-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-1,2-oxazole-5-carboxylic acid

C10H7N3O3S — CID 82373609

IUPAC3-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-1,2-oxazole-5-carboxylic acid
SMILESCc1nc2sccn2c1-c1cc(C(=O)O)on1
InChIInChI=1S/C10H7N3O3S/c1-5-8(13-2-3-17-10(13)11-5)6-4-7(9(14)15)16-12-6/h2-4H,1H3,(H,14,15)
InChIKeyIYIIYKYKDJKIMA-UHFFFAOYSA-N
MW249.25 g/mol
LogP2.06
Rot. Bonds2

About 3-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-1,2-oxazole-5-carboxylic acid

3-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-1,2-oxazole-5-carboxylic acid (PubChem CID 82373609) has the molecular formula C10H7N3O3S and a molecular weight of 249.25 g/mol. Its IUPAC name is 3-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-1,2-oxazole-5-carboxylic acid.

Molecular Properties

Compound Name3-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-1,2-oxazole-5-carboxylic acid
PubChem CID82373609
Molecular FormulaC10H7N3O3S
Molecular Weight249.25 g/mol
Exact Mass249.02
IUPAC Name3-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-1,2-oxazole-5-carboxylic acid
SMILESCc1nc2sccn2c1-c1cc(C(=O)O)on1
InChIInChI=1S/C10H7N3O3S/c1-5-8(13-2-3-17-10(13)11-5)6-4-7(9(14)15)16-12-6/h2-4H,1H3,(H,14,15)
InChIKeyIYIIYKYKDJKIMA-UHFFFAOYSA-N
XLogP2.06
TPSA80.63 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.25
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-Imidazo[2,1-b][1,3]thiazol-5-yl-1,2-oxazole-5-carboxylic acid
CID 82373608
3-Imidazo[2,1-b][1,3]thiazol-6-yl-1,2-oxazole-5-carboxylic acid
CID 82373610
3-(5-Methylimidazo[2,1-b][1,3]thiazol-6-yl)-1,2-oxazole-5-carboxylic acid
CID 82373611
3-(2-Methylimidazo[2,1-b][1,3]thiazol-6-yl)-1,2-oxazole-5-carboxylic acid
CID 82373612
3-Imidazo[2,1-b][1,3]thiazol-2-yl-1,2-oxazole-5-carboxylic acid
CID 82373613
3-(2-methyl-1H-imidazo[1,2-a]imidazol-6-yl)-1,2-oxazole-5-carboxylic acid
CID 82373614
3-Imidazo[2,1-b][1,3]thiazol-5-yl-4-methyl-1,2-oxazole-5-carboxylic acid
CID 82373619
3-Imidazo[2,1-b][1,3]thiazol-6-yl-4-methyl-1,2-oxazole-5-carboxylic acid
CID 82373620
3-Imidazo[2,1-b][1,3]thiazol-2-yl-4-methyl-1,2-oxazole-5-carboxylic acid
CID 82373621
4-Imidazo[2,1-b][1,3]thiazol-5-yl-3-methyl-1,2-oxazole-5-carboxylic acid
CID 82373642
4-Imidazo[2,1-b][1,3]thiazol-6-yl-3-methyl-1,2-oxazole-5-carboxylic acid
CID 82373643
4-Imidazo[2,1-b][1,3]thiazol-2-yl-3-methyl-1,2-oxazole-5-carboxylic acid
CID 82373644

Frequently Asked Questions

What is the IUPAC name of 3-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-1,2-oxazole-5-carboxylic acid?
The IUPAC name of 3-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-1,2-oxazole-5-carboxylic acid (CID 82373609) is 3-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-1,2-oxazole-5-carboxylic acid.
What is the SMILES notation for 3-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-1,2-oxazole-5-carboxylic acid?
The canonical SMILES for 3-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-1,2-oxazole-5-carboxylic acid is Cc1nc2sccn2c1-c1cc(C(=O)O)on1.
What is the InChIKey of 3-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-1,2-oxazole-5-carboxylic acid?
The InChIKey is IYIIYKYKDJKIMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7N3O3S/c1-5-8(13-2-3-17-10(13)11-5)6-4-7(9(14)15)16-12-6/h2-4H,1H3,(H,14,15).
What are the key properties of 3-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-1,2-oxazole-5-carboxylic acid?
3-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-1,2-oxazole-5-carboxylic acid has a molecular weight of 249.25 g/mol, XLogP of 2.06, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-1,2-oxazole-5-carboxylic acid is sourced from PubChem (CID 82373609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).