2-[6-(furan-2-yl)-3-pyridin-3-ylimidazo[2,1-b][1,3]thiazol-5-yl]acetic acid

C16H11N3O3S — CID 82062379

IUPAC2-[6-(furan-2-yl)-3-pyridin-3-ylimidazo[2,1-b][1,3]thiazol-5-yl]acetic acid
SMILESO=C(O)Cc1c(-c2ccco2)nc2scc(-c3cccnc3)n12
InChIInChI=1S/C16H11N3O3S/c20-14(21)7-11-15(13-4-2-6-22-13)18-16-19(11)12(9-23-16)10-3-1-5-17-8-10/h1-6,8-9H,7H2,(H,20,21)
InChIKeyVQHJBOIBESTNTM-UHFFFAOYSA-N
MW325.35 g/mol
LogP3.34
Rot. Bonds4

About 2-[6-(furan-2-yl)-3-pyridin-3-ylimidazo[2,1-b][1,3]thiazol-5-yl]acetic acid

2-[6-(furan-2-yl)-3-pyridin-3-ylimidazo[2,1-b][1,3]thiazol-5-yl]acetic acid (PubChem CID 82062379) has the molecular formula C16H11N3O3S and a molecular weight of 325.35 g/mol. Its IUPAC name is 2-[6-(furan-2-yl)-3-pyridin-3-ylimidazo[2,1-b][1,3]thiazol-5-yl]acetic acid.

Molecular Properties

Compound Name2-[6-(furan-2-yl)-3-pyridin-3-ylimidazo[2,1-b][1,3]thiazol-5-yl]acetic acid
PubChem CID82062379
Molecular FormulaC16H11N3O3S
Molecular Weight325.35 g/mol
Exact Mass325.05
IUPAC Name2-[6-(furan-2-yl)-3-pyridin-3-ylimidazo[2,1-b][1,3]thiazol-5-yl]acetic acid
SMILESO=C(O)Cc1c(-c2ccco2)nc2scc(-c3cccnc3)n12
InChIInChI=1S/C16H11N3O3S/c20-14(21)7-11-15(13-4-2-6-22-13)18-16-19(11)12(9-23-16)10-3-1-5-17-8-10/h1-6,8-9H,7H2,(H,20,21)
InChIKeyVQHJBOIBESTNTM-UHFFFAOYSA-N
XLogP3.34
TPSA80.63 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.35
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[6-(furan-2-yl)-3-pyridin-4-ylimidazo[2,1-b][1,3]thiazol-5-yl]acetic acid
CID 82062382
2-[6-(furan-2-yl)-3-phenylimidazo[2,1-b][1,3]thiazol-5-yl]acetic acid
CID 82062327
2-[3,6-bis(furan-2-yl)imidazo[2,1-b][1,3]thiazol-5-yl]acetic acid
CID 93210596
2-[3-tert-butyl-6-(furan-2-yl)imidazo[2,1-b][1,3]thiazol-5-yl]acetic acid
CID 82062345
2-(3,6-dipyridin-3-ylimidazo[2,1-b][1,3]thiazol-5-yl)acetonitrile
CID 93210732
2-(3-pyridin-3-yl-6-thiophen-2-ylimidazo[2,1-b][1,3]thiazol-5-yl)ethanamine
CID 82062562
3-pyridin-3-ylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid
CID 82062120
2-[3-(furan-2-yl)imidazo[2,1-b][1,3]thiazol-6-yl]acetic acid
CID 82035969
6-(4-methylphenyl)-3-pyridin-3-ylimidazo[2,1-b][1,3]thiazol-5-amine
CID 93216195
2-(2-pyridin-3-yl-5,6,7,8-tetrahydroimidazo[2,1-b][1,3]benzothiazol-1-yl)acetic acid
CID 93211194
7-amino-3-pyridin-3-yl-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 139236707
2-[6-methyl-3-(1-methylpyrrol-3-yl)imidazo[2,1-b][1,3]thiazol-5-yl]acetic acid
CID 98019202

Frequently Asked Questions

What is the IUPAC name of 2-[6-(furan-2-yl)-3-pyridin-3-ylimidazo[2,1-b][1,3]thiazol-5-yl]acetic acid?
The IUPAC name of 2-[6-(furan-2-yl)-3-pyridin-3-ylimidazo[2,1-b][1,3]thiazol-5-yl]acetic acid (CID 82062379) is 2-[6-(furan-2-yl)-3-pyridin-3-ylimidazo[2,1-b][1,3]thiazol-5-yl]acetic acid.
What is the SMILES notation for 2-[6-(furan-2-yl)-3-pyridin-3-ylimidazo[2,1-b][1,3]thiazol-5-yl]acetic acid?
The canonical SMILES for 2-[6-(furan-2-yl)-3-pyridin-3-ylimidazo[2,1-b][1,3]thiazol-5-yl]acetic acid is O=C(O)Cc1c(-c2ccco2)nc2scc(-c3cccnc3)n12.
What is the InChIKey of 2-[6-(furan-2-yl)-3-pyridin-3-ylimidazo[2,1-b][1,3]thiazol-5-yl]acetic acid?
The InChIKey is VQHJBOIBESTNTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11N3O3S/c20-14(21)7-11-15(13-4-2-6-22-13)18-16-19(11)12(9-23-16)10-3-1-5-17-8-10/h1-6,8-9H,7H2,(H,20,21).
What are the key properties of 2-[6-(furan-2-yl)-3-pyridin-3-ylimidazo[2,1-b][1,3]thiazol-5-yl]acetic acid?
2-[6-(furan-2-yl)-3-pyridin-3-ylimidazo[2,1-b][1,3]thiazol-5-yl]acetic acid has a molecular weight of 325.35 g/mol, XLogP of 3.34, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(furan-2-yl)-3-pyridin-3-ylimidazo[2,1-b][1,3]thiazol-5-yl]acetic acid is sourced from PubChem (CID 82062379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).