6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide

C6H4F3N3O2S2 — CID 14422483

IUPAC6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
SMILESNS(=O)(=O)c1c(C(F)(F)F)nc2sccn12
InChIInChI=1S/C6H4F3N3O2S2/c7-6(8,9)3-4(16(10,13)14)12-1-2-15-5(12)11-3/h1-2H,(H2,10,13,14)
InChIKeyDEOOQXCLYFVQQT-UHFFFAOYSA-N
MW271.25 g/mol
LogP1.06
Rot. Bonds1

About 6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide

6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide (PubChem CID 14422483) has the molecular formula C6H4F3N3O2S2 and a molecular weight of 271.25 g/mol. Its IUPAC name is 6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide.

Molecular Properties

Compound Name6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
PubChem CID14422483
Molecular FormulaC6H4F3N3O2S2
Molecular Weight271.25 g/mol
Exact Mass270.97
IUPAC Name6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
SMILESNS(=O)(=O)c1c(C(F)(F)F)nc2sccn12
InChIInChI=1S/C6H4F3N3O2S2/c7-6(8,9)3-4(16(10,13)14)12-1-2-15-5(12)11-3/h1-2H,(H2,10,13,14)
InChIKeyDEOOQXCLYFVQQT-UHFFFAOYSA-N
XLogP1.06
TPSA77.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.25
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide?
The IUPAC name of 6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide (CID 14422483) is 6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide.
What is the SMILES notation for 6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide?
The canonical SMILES for 6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide is NS(=O)(=O)c1c(C(F)(F)F)nc2sccn12.
What is the InChIKey of 6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide?
The InChIKey is DEOOQXCLYFVQQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4F3N3O2S2/c7-6(8,9)3-4(16(10,13)14)12-1-2-15-5(12)11-3/h1-2H,(H2,10,13,14).
What are the key properties of 6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide?
6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide has a molecular weight of 271.25 g/mol, XLogP of 1.06, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide is sourced from PubChem (CID 14422483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).