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

C15H10N2O4S — CID 93210596

IUPAC2-[3,6-bis(furan-2-yl)imidazo[2,1-b][1,3]thiazol-5-yl]acetic acid
SMILESO=C(O)Cc1c(-c2ccco2)nc2scc(-c3ccco3)n12
InChIInChI=1S/C15H10N2O4S/c18-13(19)7-9-14(12-4-2-6-21-12)16-15-17(9)10(8-22-15)11-3-1-5-20-11/h1-6,8H,7H2,(H,18,19)
InChIKeyKSTHSCAARIRPPH-UHFFFAOYSA-N
MW314.32 g/mol
LogP3.54
Rot. Bonds4

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

2-[3,6-bis(furan-2-yl)imidazo[2,1-b][1,3]thiazol-5-yl]acetic acid (PubChem CID 93210596) has the molecular formula C15H10N2O4S and a molecular weight of 314.32 g/mol. Its IUPAC name is 2-[3,6-bis(furan-2-yl)imidazo[2,1-b][1,3]thiazol-5-yl]acetic acid.

Molecular Properties

Compound Name2-[3,6-bis(furan-2-yl)imidazo[2,1-b][1,3]thiazol-5-yl]acetic acid
PubChem CID93210596
Molecular FormulaC15H10N2O4S
Molecular Weight314.32 g/mol
Exact Mass314.04
IUPAC Name2-[3,6-bis(furan-2-yl)imidazo[2,1-b][1,3]thiazol-5-yl]acetic acid
SMILESO=C(O)Cc1c(-c2ccco2)nc2scc(-c3ccco3)n12
InChIInChI=1S/C15H10N2O4S/c18-13(19)7-9-14(12-4-2-6-21-12)16-15-17(9)10(8-22-15)11-3-1-5-20-11/h1-6,8H,7H2,(H,18,19)
InChIKeyKSTHSCAARIRPPH-UHFFFAOYSA-N
XLogP3.54
TPSA80.88 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.32
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[6-(furan-2-yl)-3-phenylimidazo[2,1-b][1,3]thiazol-5-yl]acetic acid
CID 82062327
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-pyridin-3-ylimidazo[2,1-b][1,3]thiazol-5-yl]acetic acid
CID 82062379
2-[3-tert-butyl-6-(furan-2-yl)imidazo[2,1-b][1,3]thiazol-5-yl]acetic acid
CID 82062345
2-[3-(furan-2-yl)imidazo[2,1-b][1,3]thiazol-6-yl]acetic acid
CID 82035969
2-[3-(furan-2-yl)-6-(4-methylphenyl)imidazo[2,1-b][1,3]thiazol-5-yl]acetonitrile
CID 93210749
3-(furan-2-yl)-6-thiophen-2-ylimidazo[2,1-b][1,3]thiazol-5-amine
CID 82068730
2-[2-(furan-2-yl)-1,3-thiazol-4-yl]acetic acid
CID 7176378
ethyl 2-[5-amino-6-(furan-2-yl)imidazo[2,1-b][1,3]thiazol-3-yl]acetate
CID 82068757
3-(4-ethylphenyl)-6-(furan-2-yl)imidazo[2,1-b][1,3]thiazol-5-amine
CID 93216173
2-[6-methyl-3-(1-methylpyrrol-3-yl)imidazo[2,1-b][1,3]thiazol-5-yl]acetic acid
CID 98019202
6-(furan-2-yl)-3-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-5-amine
CID 93216185

Frequently Asked Questions

What is the IUPAC name of 2-[3,6-bis(furan-2-yl)imidazo[2,1-b][1,3]thiazol-5-yl]acetic acid?
The IUPAC name of 2-[3,6-bis(furan-2-yl)imidazo[2,1-b][1,3]thiazol-5-yl]acetic acid (CID 93210596) is 2-[3,6-bis(furan-2-yl)imidazo[2,1-b][1,3]thiazol-5-yl]acetic acid.
What is the SMILES notation for 2-[3,6-bis(furan-2-yl)imidazo[2,1-b][1,3]thiazol-5-yl]acetic acid?
The canonical SMILES for 2-[3,6-bis(furan-2-yl)imidazo[2,1-b][1,3]thiazol-5-yl]acetic acid is O=C(O)Cc1c(-c2ccco2)nc2scc(-c3ccco3)n12.
What is the InChIKey of 2-[3,6-bis(furan-2-yl)imidazo[2,1-b][1,3]thiazol-5-yl]acetic acid?
The InChIKey is KSTHSCAARIRPPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N2O4S/c18-13(19)7-9-14(12-4-2-6-21-12)16-15-17(9)10(8-22-15)11-3-1-5-20-11/h1-6,8H,7H2,(H,18,19).
What are the key properties of 2-[3,6-bis(furan-2-yl)imidazo[2,1-b][1,3]thiazol-5-yl]acetic acid?
2-[3,6-bis(furan-2-yl)imidazo[2,1-b][1,3]thiazol-5-yl]acetic acid has a molecular weight of 314.32 g/mol, XLogP of 3.54, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3,6-bis(furan-2-yl)imidazo[2,1-b][1,3]thiazol-5-yl]acetic acid is sourced from PubChem (CID 93210596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).