N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)ethanesulfonamide

C13H13N3O2S2 — CID 7151338

IUPACN-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)ethanesulfonamide
SMILESCCS(=O)(=O)Nc1ccc(-c2cn3ccsc3n2)cc1
InChIInChI=1S/C13H13N3O2S2/c1-2-20(17,18)15-11-5-3-10(4-6-11)12-9-16-7-8-19-13(16)14-12/h3-9,15H,2H2,1H3
InChIKeyVTJHPUWDJYZPBC-UHFFFAOYSA-N
MW307.40 g/mol
LogP2.82
Rot. Bonds4

About N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)ethanesulfonamide

N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)ethanesulfonamide (PubChem CID 7151338) has the molecular formula C13H13N3O2S2 and a molecular weight of 307.40 g/mol. Its IUPAC name is N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)ethanesulfonamide.

Molecular Properties

Compound NameN-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)ethanesulfonamide
PubChem CID7151338
Molecular FormulaC13H13N3O2S2
Molecular Weight307.40 g/mol
Exact Mass307.04
IUPAC NameN-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)ethanesulfonamide
SMILESCCS(=O)(=O)Nc1ccc(-c2cn3ccsc3n2)cc1
InChIInChI=1S/C13H13N3O2S2/c1-2-20(17,18)15-11-5-3-10(4-6-11)12-9-16-7-8-19-13(16)14-12/h3-9,15H,2H2,1H3
InChIKeyVTJHPUWDJYZPBC-UHFFFAOYSA-N
XLogP2.82
TPSA63.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.40
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)ethanesulfonamide 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 N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)ethanesulfonamide?
The IUPAC name of N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)ethanesulfonamide (CID 7151338) is N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)ethanesulfonamide.
What is the SMILES notation for N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)ethanesulfonamide?
The canonical SMILES for N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)ethanesulfonamide is CCS(=O)(=O)Nc1ccc(-c2cn3ccsc3n2)cc1.
What is the InChIKey of N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)ethanesulfonamide?
The InChIKey is VTJHPUWDJYZPBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O2S2/c1-2-20(17,18)15-11-5-3-10(4-6-11)12-9-16-7-8-19-13(16)14-12/h3-9,15H,2H2,1H3.
What are the key properties of N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)ethanesulfonamide?
N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)ethanesulfonamide has a molecular weight of 307.40 g/mol, XLogP of 2.82, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)ethanesulfonamide is sourced from PubChem (CID 7151338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).