6-phenoxyimidazo[2,1-b][1,3]thiazole-5-carboxylic acid

C12H8N2O3S — CID 43475881

IUPAC6-phenoxyimidazo[2,1-b][1,3]thiazole-5-carboxylic acid
SMILESO=C(O)c1c(Oc2ccccc2)nc2sccn12
InChIInChI=1S/C12H8N2O3S/c15-11(16)9-10(13-12-14(9)6-7-18-12)17-8-4-2-1-3-5-8/h1-7H,(H,15,16)
InChIKeyGEELTGWCOCWQMJ-UHFFFAOYSA-N
MW260.27 g/mol
LogP2.89
Rot. Bonds3

About 6-phenoxyimidazo[2,1-b][1,3]thiazole-5-carboxylic acid

6-phenoxyimidazo[2,1-b][1,3]thiazole-5-carboxylic acid (PubChem CID 43475881) has the molecular formula C12H8N2O3S and a molecular weight of 260.27 g/mol. Its IUPAC name is 6-phenoxyimidazo[2,1-b][1,3]thiazole-5-carboxylic acid.

Molecular Properties

Compound Name6-phenoxyimidazo[2,1-b][1,3]thiazole-5-carboxylic acid
PubChem CID43475881
Molecular FormulaC12H8N2O3S
Molecular Weight260.27 g/mol
Exact Mass260.03
IUPAC Name6-phenoxyimidazo[2,1-b][1,3]thiazole-5-carboxylic acid
SMILESO=C(O)c1c(Oc2ccccc2)nc2sccn12
InChIInChI=1S/C12H8N2O3S/c15-11(16)9-10(13-12-14(9)6-7-18-12)17-8-4-2-1-3-5-8/h1-7H,(H,15,16)
InChIKeyGEELTGWCOCWQMJ-UHFFFAOYSA-N
XLogP2.89
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.27
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(4-bromophenoxy)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid
CID 43475866
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-(1-propylpyrazol-4-yl)oxyimidazo[2,1-b][1,3]thiazole-5-carboxylic acid
CID 116801912
6-(2-chloro-5-methylphenoxy)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid
CID 43475907
(6-pyridin-3-yloxyimidazo[2,1-b][1,3]thiazol-5-yl)methanol
CID 43476184
[4-[5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-6-yl]oxyphenyl]methanol
CID 61229919
2-[4-(hydroxymethyl)phenoxy]imidazo[1,2-a]pyridine-3-carboxylic acid
CID 61360290
[6-(3-methylphenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanol
CID 43476129
8-(6-phenylimidazo[2,1-b][1,3]thiazole-5-carbonyl)oxyoctyl 6-phenylimidazo[2,1-b][1,3]thiazole-5-carboxylate
CID 11592429
6-(3-carbamoylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid
CID 64780586
ethyl 6-phenylimidazo[2,1-b][1,3]thiazole-5-carboxylate
CID 10802132

Frequently Asked Questions

What is the IUPAC name of 6-phenoxyimidazo[2,1-b][1,3]thiazole-5-carboxylic acid?
The IUPAC name of 6-phenoxyimidazo[2,1-b][1,3]thiazole-5-carboxylic acid (CID 43475881) is 6-phenoxyimidazo[2,1-b][1,3]thiazole-5-carboxylic acid.
What is the SMILES notation for 6-phenoxyimidazo[2,1-b][1,3]thiazole-5-carboxylic acid?
The canonical SMILES for 6-phenoxyimidazo[2,1-b][1,3]thiazole-5-carboxylic acid is O=C(O)c1c(Oc2ccccc2)nc2sccn12.
What is the InChIKey of 6-phenoxyimidazo[2,1-b][1,3]thiazole-5-carboxylic acid?
The InChIKey is GEELTGWCOCWQMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8N2O3S/c15-11(16)9-10(13-12-14(9)6-7-18-12)17-8-4-2-1-3-5-8/h1-7H,(H,15,16).
What are the key properties of 6-phenoxyimidazo[2,1-b][1,3]thiazole-5-carboxylic acid?
6-phenoxyimidazo[2,1-b][1,3]thiazole-5-carboxylic acid has a molecular weight of 260.27 g/mol, XLogP of 2.89, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-phenoxyimidazo[2,1-b][1,3]thiazole-5-carboxylic acid is sourced from PubChem (CID 43475881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).