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

C12H11N3O2S2 — CID 2101487

IUPACN-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)methanesulfonamide
SMILESCS(=O)(=O)Nc1ccc(-c2cn3ccsc3n2)cc1
InChIInChI=1S/C12H11N3O2S2/c1-19(16,17)14-10-4-2-9(3-5-10)11-8-15-6-7-18-12(15)13-11/h2-8,14H,1H3
InChIKeyCQFNWVCNMCXCKF-UHFFFAOYSA-N
MW293.37 g/mol
LogP2.43
Rot. Bonds3

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

N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)methanesulfonamide (PubChem CID 2101487) has the molecular formula C12H11N3O2S2 and a molecular weight of 293.37 g/mol. Its IUPAC name is N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)methanesulfonamide.

Molecular Properties

Compound NameN-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)methanesulfonamide
PubChem CID2101487
Molecular FormulaC12H11N3O2S2
Molecular Weight293.37 g/mol
Exact Mass293.03
IUPAC NameN-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)methanesulfonamide
SMILESCS(=O)(=O)Nc1ccc(-c2cn3ccsc3n2)cc1
InChIInChI=1S/C12H11N3O2S2/c1-19(16,17)14-10-4-2-9(3-5-10)11-8-15-6-7-18-12(15)13-11/h2-8,14H,1H3
InChIKeyCQFNWVCNMCXCKF-UHFFFAOYSA-N
XLogP2.43
TPSA63.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)methanesulfonamide?
The IUPAC name of N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)methanesulfonamide (CID 2101487) is N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)methanesulfonamide.
What is the SMILES notation for N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)methanesulfonamide?
The canonical SMILES for N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)methanesulfonamide is CS(=O)(=O)Nc1ccc(-c2cn3ccsc3n2)cc1.
What is the InChIKey of N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)methanesulfonamide?
The InChIKey is CQFNWVCNMCXCKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3O2S2/c1-19(16,17)14-10-4-2-9(3-5-10)11-8-15-6-7-18-12(15)13-11/h2-8,14H,1H3.
What are the key properties of N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)methanesulfonamide?
N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)methanesulfonamide has a molecular weight of 293.37 g/mol, XLogP of 2.43, 3 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)methanesulfonamide is sourced from PubChem (CID 2101487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).