[6-(2,4-difluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanol

C12H8F2N2O2S — CID 43476074

IUPAC[6-(2,4-difluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanol
SMILESOCc1c(Oc2ccc(F)cc2F)nc2sccn12
InChIInChI=1S/C12H8F2N2O2S/c13-7-1-2-10(8(14)5-7)18-11-9(6-17)16-3-4-19-12(16)15-11/h1-5,17H,6H2
InChIKeyXALOQCWDRKPOCT-UHFFFAOYSA-N
MW282.27 g/mol
LogP2.96
Rot. Bonds3

About [6-(2,4-difluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanol

[6-(2,4-difluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanol (PubChem CID 43476074) has the molecular formula C12H8F2N2O2S and a molecular weight of 282.27 g/mol. Its IUPAC name is [6-(2,4-difluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanol.

Molecular Properties

Compound Name[6-(2,4-difluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanol
PubChem CID43476074
Molecular FormulaC12H8F2N2O2S
Molecular Weight282.27 g/mol
Exact Mass282.03
IUPAC Name[6-(2,4-difluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanol
SMILESOCc1c(Oc2ccc(F)cc2F)nc2sccn12
InChIInChI=1S/C12H8F2N2O2S/c13-7-1-2-10(8(14)5-7)18-11-9(6-17)16-3-4-19-12(16)15-11/h1-5,17H,6H2
InChIKeyXALOQCWDRKPOCT-UHFFFAOYSA-N
XLogP2.96
TPSA46.76 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.27
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [6-(2,4-difluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanol?
The IUPAC name of [6-(2,4-difluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanol (CID 43476074) is [6-(2,4-difluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanol.
What is the SMILES notation for [6-(2,4-difluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanol?
The canonical SMILES for [6-(2,4-difluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanol is OCc1c(Oc2ccc(F)cc2F)nc2sccn12.
What is the InChIKey of [6-(2,4-difluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanol?
The InChIKey is XALOQCWDRKPOCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8F2N2O2S/c13-7-1-2-10(8(14)5-7)18-11-9(6-17)16-3-4-19-12(16)15-11/h1-5,17H,6H2.
What are the key properties of [6-(2,4-difluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanol?
[6-(2,4-difluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanol has a molecular weight of 282.27 g/mol, XLogP of 2.96, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2,4-difluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]methanol is sourced from PubChem (CID 43476074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).