2-bromo-6-(3-fluorophenyl)imidazo[2,1-b][1,3]thiazole

C11H6BrFN2S — CID 45158654

IUPAC2-bromo-6-(3-fluorophenyl)imidazo[2,1-b][1,3]thiazole
SMILESFc1cccc(-c2cn3cc(Br)sc3n2)c1
InChIInChI=1S/C11H6BrFN2S/c12-10-6-15-5-9(14-11(15)16-10)7-2-1-3-8(13)4-7/h1-6H
InChIKeyIQFWROVHFGFOMY-UHFFFAOYSA-N
MW297.15 g/mol
LogP3.96
Rot. Bonds1

About 2-bromo-6-(3-fluorophenyl)imidazo[2,1-b][1,3]thiazole

2-bromo-6-(3-fluorophenyl)imidazo[2,1-b][1,3]thiazole (PubChem CID 45158654) has the molecular formula C11H6BrFN2S and a molecular weight of 297.15 g/mol. Its IUPAC name is 2-bromo-6-(3-fluorophenyl)imidazo[2,1-b][1,3]thiazole.

Molecular Properties

Compound Name2-bromo-6-(3-fluorophenyl)imidazo[2,1-b][1,3]thiazole
PubChem CID45158654
Molecular FormulaC11H6BrFN2S
Molecular Weight297.15 g/mol
Exact Mass295.94
IUPAC Name2-bromo-6-(3-fluorophenyl)imidazo[2,1-b][1,3]thiazole
SMILESFc1cccc(-c2cn3cc(Br)sc3n2)c1
InChIInChI=1S/C11H6BrFN2S/c12-10-6-15-5-9(14-11(15)16-10)7-2-1-3-8(13)4-7/h1-6H
InChIKeyIQFWROVHFGFOMY-UHFFFAOYSA-N
XLogP3.96
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.15
LogP ≤ 53.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-bromo-6-(3-fluorophenyl)imidazo[2,1-b][1,3]thiazole?
The IUPAC name of 2-bromo-6-(3-fluorophenyl)imidazo[2,1-b][1,3]thiazole (CID 45158654) is 2-bromo-6-(3-fluorophenyl)imidazo[2,1-b][1,3]thiazole.
What is the SMILES notation for 2-bromo-6-(3-fluorophenyl)imidazo[2,1-b][1,3]thiazole?
The canonical SMILES for 2-bromo-6-(3-fluorophenyl)imidazo[2,1-b][1,3]thiazole is Fc1cccc(-c2cn3cc(Br)sc3n2)c1.
What is the InChIKey of 2-bromo-6-(3-fluorophenyl)imidazo[2,1-b][1,3]thiazole?
The InChIKey is IQFWROVHFGFOMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6BrFN2S/c12-10-6-15-5-9(14-11(15)16-10)7-2-1-3-8(13)4-7/h1-6H.
What are the key properties of 2-bromo-6-(3-fluorophenyl)imidazo[2,1-b][1,3]thiazole?
2-bromo-6-(3-fluorophenyl)imidazo[2,1-b][1,3]thiazole has a molecular weight of 297.15 g/mol, XLogP of 3.96, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-6-(3-fluorophenyl)imidazo[2,1-b][1,3]thiazole is sourced from PubChem (CID 45158654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).