1-[3-(7-fluoro-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]ethanol

C15H13FN2O2S — CID 142131133

IUPAC1-[3-(7-fluoro-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]ethanol
SMILESCC(O)C1=C(c2ccc(F)c3occc23)N2CCN=C2S1
InChIInChI=1S/C15H13FN2O2S/c1-8(19)14-12(18-6-5-17-15(18)21-14)9-2-3-11(16)13-10(9)4-7-20-13/h2-4,7-8,19H,5-6H2,1H3
InChIKeyYVAYKBIZINYDGZ-UHFFFAOYSA-N
MW304.35 g/mol
LogP3.04
Rot. Bonds2

About 1-[3-(7-fluoro-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]ethanol

1-[3-(7-fluoro-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]ethanol (PubChem CID 142131133) has the molecular formula C15H13FN2O2S and a molecular weight of 304.35 g/mol. Its IUPAC name is 1-[3-(7-fluoro-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]ethanol.

Molecular Properties

Compound Name1-[3-(7-fluoro-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]ethanol
PubChem CID142131133
Molecular FormulaC15H13FN2O2S
Molecular Weight304.35 g/mol
Exact Mass304.07
IUPAC Name1-[3-(7-fluoro-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]ethanol
SMILESCC(O)C1=C(c2ccc(F)c3occc23)N2CCN=C2S1
InChIInChI=1S/C15H13FN2O2S/c1-8(19)14-12(18-6-5-17-15(18)21-14)9-2-3-11(16)13-10(9)4-7-20-13/h2-4,7-8,19H,5-6H2,1H3
InChIKeyYVAYKBIZINYDGZ-UHFFFAOYSA-N
XLogP3.04
TPSA48.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-[3-(7-fluoro-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]ethanol with MolForge

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Related Compounds

1-[3-(4-methyl-1-benzofuran-6-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]ethanol
CID 142131047
[3-(7-methylsulfanyl-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]methanol
CID 142130944
1-[3-(1-benzofuran-6-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]ethanol
CID 142130972
1-[3-(6-chloro-1-benzothiophen-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]ethanol
CID 22474190
2-ethyl-3-(7-methyl-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole
CID 142130957
1-[3-(7-fluoro-1-benzothiophen-2-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]ethanol
CID 22473931
[3-(7-methoxy-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]methanol
CID 142130965
1-[3-(5-methylsulfanyl-1-benzothiophen-7-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]ethanol
CID 22474177
3-(5-fluoro-1-benzofuran-7-yl)-2-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole
CID 142130952
1-[3-(1-benzothiophen-2-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]ethanol
CID 22473746
3-(7-fluoro-1-benzothiophen-4-yl)-2-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrobromide
CID 22474288
1-[3-(7-methylsulfanyl-1-benzothiophen-2-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]ethanol
CID 22473732

Frequently Asked Questions

What is the IUPAC name of 1-[3-(7-fluoro-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]ethanol?
The IUPAC name of 1-[3-(7-fluoro-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]ethanol (CID 142131133) is 1-[3-(7-fluoro-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]ethanol.
What is the SMILES notation for 1-[3-(7-fluoro-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]ethanol?
The canonical SMILES for 1-[3-(7-fluoro-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]ethanol is CC(O)C1=C(c2ccc(F)c3occc23)N2CCN=C2S1.
What is the InChIKey of 1-[3-(7-fluoro-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]ethanol?
The InChIKey is YVAYKBIZINYDGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FN2O2S/c1-8(19)14-12(18-6-5-17-15(18)21-14)9-2-3-11(16)13-10(9)4-7-20-13/h2-4,7-8,19H,5-6H2,1H3.
What are the key properties of 1-[3-(7-fluoro-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]ethanol?
1-[3-(7-fluoro-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]ethanol has a molecular weight of 304.35 g/mol, XLogP of 3.04, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(7-fluoro-1-benzofuran-4-yl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]ethanol is sourced from PubChem (CID 142131133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).