6-amino-N-(3-fluoro-2-methylphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide

C12H11FN4O2S2 — CID 62157983

IUPAC6-amino-N-(3-fluoro-2-methylphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
SMILESCc1c(F)cccc1NS(=O)(=O)c1c(N)nc2sccn12
InChIInChI=1S/C12H11FN4O2S2/c1-7-8(13)3-2-4-9(7)16-21(18,19)11-10(14)15-12-17(11)5-6-20-12/h2-6,16H,14H2,1H3
InChIKeyIJFGRBZMMNTKIC-UHFFFAOYSA-N
MW326.38 g/mol
LogP2.23
Rot. Bonds3

About 6-amino-N-(3-fluoro-2-methylphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide

6-amino-N-(3-fluoro-2-methylphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide (PubChem CID 62157983) has the molecular formula C12H11FN4O2S2 and a molecular weight of 326.38 g/mol. Its IUPAC name is 6-amino-N-(3-fluoro-2-methylphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide.

Molecular Properties

Compound Name6-amino-N-(3-fluoro-2-methylphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
PubChem CID62157983
Molecular FormulaC12H11FN4O2S2
Molecular Weight326.38 g/mol
Exact Mass326.03
IUPAC Name6-amino-N-(3-fluoro-2-methylphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
SMILESCc1c(F)cccc1NS(=O)(=O)c1c(N)nc2sccn12
InChIInChI=1S/C12H11FN4O2S2/c1-7-8(13)3-2-4-9(7)16-21(18,19)11-10(14)15-12-17(11)5-6-20-12/h2-6,16H,14H2,1H3
InChIKeyIJFGRBZMMNTKIC-UHFFFAOYSA-N
XLogP2.23
TPSA89.49 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.38
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 6-amino-N-(3-fluoro-2-methylphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-(3-fluoro-2-methylphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide?
The IUPAC name of 6-amino-N-(3-fluoro-2-methylphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide (CID 62157983) is 6-amino-N-(3-fluoro-2-methylphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide.
What is the SMILES notation for 6-amino-N-(3-fluoro-2-methylphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide?
The canonical SMILES for 6-amino-N-(3-fluoro-2-methylphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide is Cc1c(F)cccc1NS(=O)(=O)c1c(N)nc2sccn12.
What is the InChIKey of 6-amino-N-(3-fluoro-2-methylphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide?
The InChIKey is IJFGRBZMMNTKIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11FN4O2S2/c1-7-8(13)3-2-4-9(7)16-21(18,19)11-10(14)15-12-17(11)5-6-20-12/h2-6,16H,14H2,1H3.
What are the key properties of 6-amino-N-(3-fluoro-2-methylphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide?
6-amino-N-(3-fluoro-2-methylphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide has a molecular weight of 326.38 g/mol, XLogP of 2.23, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(3-fluoro-2-methylphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide is sourced from PubChem (CID 62157983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).