6-(2-fluoro-4-methylphenyl)-2-methylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid

C14H11FN2O2S — CID 71262912

IUPAC6-(2-fluoro-4-methylphenyl)-2-methylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid
SMILESCc1ccc(-c2nc3sc(C)cn3c2C(=O)O)c(F)c1
InChIInChI=1S/C14H11FN2O2S/c1-7-3-4-9(10(15)5-7)11-12(13(18)19)17-6-8(2)20-14(17)16-11/h3-6H,1-2H3,(H,18,19)
InChIKeyUWXZDVLCSPRASU-UHFFFAOYSA-N
MW290.32 g/mol
LogP3.52
Rot. Bonds2

About 6-(2-fluoro-4-methylphenyl)-2-methylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid

6-(2-fluoro-4-methylphenyl)-2-methylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid (PubChem CID 71262912) has the molecular formula C14H11FN2O2S and a molecular weight of 290.32 g/mol. Its IUPAC name is 6-(2-fluoro-4-methylphenyl)-2-methylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid.

Molecular Properties

Compound Name6-(2-fluoro-4-methylphenyl)-2-methylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid
PubChem CID71262912
Molecular FormulaC14H11FN2O2S
Molecular Weight290.32 g/mol
Exact Mass290.05
IUPAC Name6-(2-fluoro-4-methylphenyl)-2-methylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid
SMILESCc1ccc(-c2nc3sc(C)cn3c2C(=O)O)c(F)c1
InChIInChI=1S/C14H11FN2O2S/c1-7-3-4-9(10(15)5-7)11-12(13(18)19)17-6-8(2)20-14(17)16-11/h3-6H,1-2H3,(H,18,19)
InChIKeyUWXZDVLCSPRASU-UHFFFAOYSA-N
XLogP3.52
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(2-fluoro-4-methylphenyl)-2-methylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid?
The IUPAC name of 6-(2-fluoro-4-methylphenyl)-2-methylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid (CID 71262912) is 6-(2-fluoro-4-methylphenyl)-2-methylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid.
What is the SMILES notation for 6-(2-fluoro-4-methylphenyl)-2-methylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid?
The canonical SMILES for 6-(2-fluoro-4-methylphenyl)-2-methylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid is Cc1ccc(-c2nc3sc(C)cn3c2C(=O)O)c(F)c1.
What is the InChIKey of 6-(2-fluoro-4-methylphenyl)-2-methylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid?
The InChIKey is UWXZDVLCSPRASU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11FN2O2S/c1-7-3-4-9(10(15)5-7)11-12(13(18)19)17-6-8(2)20-14(17)16-11/h3-6H,1-2H3,(H,18,19).
What are the key properties of 6-(2-fluoro-4-methylphenyl)-2-methylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid?
6-(2-fluoro-4-methylphenyl)-2-methylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid has a molecular weight of 290.32 g/mol, XLogP of 3.52, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-fluoro-4-methylphenyl)-2-methylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid is sourced from PubChem (CID 71262912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).