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

C18H13FN2O2S2 — CID 15388846

IUPAC6-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)imidazo[2,1-b][1,3]thiazole
SMILESCS(=O)(=O)c1ccc(-c2c(-c3ccc(F)cc3)nc3sccn23)cc1
InChIInChI=1S/C18H13FN2O2S2/c1-25(22,23)15-8-4-13(5-9-15)17-16(12-2-6-14(19)7-3-12)20-18-21(17)10-11-24-18/h2-11H,1H3
InChIKeyIXJJAPZCYPSAJH-UHFFFAOYSA-N
MW372.45 g/mol
LogP4.27
Rot. Bonds3

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

6-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)imidazo[2,1-b][1,3]thiazole (PubChem CID 15388846) has the molecular formula C18H13FN2O2S2 and a molecular weight of 372.45 g/mol. Its IUPAC name is 6-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)imidazo[2,1-b][1,3]thiazole.

Molecular Properties

Compound Name6-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)imidazo[2,1-b][1,3]thiazole
PubChem CID15388846
Molecular FormulaC18H13FN2O2S2
Molecular Weight372.45 g/mol
Exact Mass372.04
IUPAC Name6-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)imidazo[2,1-b][1,3]thiazole
SMILESCS(=O)(=O)c1ccc(-c2c(-c3ccc(F)cc3)nc3sccn23)cc1
InChIInChI=1S/C18H13FN2O2S2/c1-25(22,23)15-8-4-13(5-9-15)17-16(12-2-6-14(19)7-3-12)20-18-21(17)10-11-24-18/h2-11H,1H3
InChIKeyIXJJAPZCYPSAJH-UHFFFAOYSA-N
XLogP4.27
TPSA51.44 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.45
LogP ≤ 54.27
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-(4-methylsulfonylphenyl)imidazo[2,1-b][1,3]thiazole?
The IUPAC name of 6-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)imidazo[2,1-b][1,3]thiazole (CID 15388846) is 6-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)imidazo[2,1-b][1,3]thiazole.
What is the SMILES notation for 6-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)imidazo[2,1-b][1,3]thiazole?
The canonical SMILES for 6-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)imidazo[2,1-b][1,3]thiazole is CS(=O)(=O)c1ccc(-c2c(-c3ccc(F)cc3)nc3sccn23)cc1.
What is the InChIKey of 6-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)imidazo[2,1-b][1,3]thiazole?
The InChIKey is IXJJAPZCYPSAJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13FN2O2S2/c1-25(22,23)15-8-4-13(5-9-15)17-16(12-2-6-14(19)7-3-12)20-18-21(17)10-11-24-18/h2-11H,1H3.
What are the key properties of 6-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)imidazo[2,1-b][1,3]thiazole?
6-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)imidazo[2,1-b][1,3]thiazole has a molecular weight of 372.45 g/mol, XLogP of 4.27, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)imidazo[2,1-b][1,3]thiazole is sourced from PubChem (CID 15388846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).