6-(4-fluorophenyl)-5-nitrosoimidazo[2,1-b][1,3]thiazole

C11H6FN3OS — CID 15062082

IUPAC6-(4-fluorophenyl)-5-nitrosoimidazo[2,1-b][1,3]thiazole
SMILESO=Nc1c(-c2ccc(F)cc2)nc2sccn12
InChIInChI=1S/C11H6FN3OS/c12-8-3-1-7(2-4-8)9-10(14-16)15-5-6-17-11(15)13-9/h1-6H
InChIKeyGMYKYCFSOBSVSA-UHFFFAOYSA-N
MW247.25 g/mol
LogP3.60
Rot. Bonds2

About 6-(4-fluorophenyl)-5-nitrosoimidazo[2,1-b][1,3]thiazole

6-(4-fluorophenyl)-5-nitrosoimidazo[2,1-b][1,3]thiazole (PubChem CID 15062082) has the molecular formula C11H6FN3OS and a molecular weight of 247.25 g/mol. Its IUPAC name is 6-(4-fluorophenyl)-5-nitrosoimidazo[2,1-b][1,3]thiazole.

Molecular Properties

Compound Name6-(4-fluorophenyl)-5-nitrosoimidazo[2,1-b][1,3]thiazole
PubChem CID15062082
Molecular FormulaC11H6FN3OS
Molecular Weight247.25 g/mol
Exact Mass247.02
IUPAC Name6-(4-fluorophenyl)-5-nitrosoimidazo[2,1-b][1,3]thiazole
SMILESO=Nc1c(-c2ccc(F)cc2)nc2sccn12
InChIInChI=1S/C11H6FN3OS/c12-8-3-1-7(2-4-8)9-10(14-16)15-5-6-17-11(15)13-9/h1-6H
InChIKeyGMYKYCFSOBSVSA-UHFFFAOYSA-N
XLogP3.60
TPSA46.73 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.25
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(4-fluorophenyl)-5-nitrosoimidazo[2,1-b][1,3]thiazole?
The IUPAC name of 6-(4-fluorophenyl)-5-nitrosoimidazo[2,1-b][1,3]thiazole (CID 15062082) is 6-(4-fluorophenyl)-5-nitrosoimidazo[2,1-b][1,3]thiazole.
What is the SMILES notation for 6-(4-fluorophenyl)-5-nitrosoimidazo[2,1-b][1,3]thiazole?
The canonical SMILES for 6-(4-fluorophenyl)-5-nitrosoimidazo[2,1-b][1,3]thiazole is O=Nc1c(-c2ccc(F)cc2)nc2sccn12.
What is the InChIKey of 6-(4-fluorophenyl)-5-nitrosoimidazo[2,1-b][1,3]thiazole?
The InChIKey is GMYKYCFSOBSVSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6FN3OS/c12-8-3-1-7(2-4-8)9-10(14-16)15-5-6-17-11(15)13-9/h1-6H.
What are the key properties of 6-(4-fluorophenyl)-5-nitrosoimidazo[2,1-b][1,3]thiazole?
6-(4-fluorophenyl)-5-nitrosoimidazo[2,1-b][1,3]thiazole has a molecular weight of 247.25 g/mol, XLogP of 3.60, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-fluorophenyl)-5-nitrosoimidazo[2,1-b][1,3]thiazole is sourced from PubChem (CID 15062082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).