N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)propane-2-sulfonamide

C14H15N3O2S2 — CID 90626781

IUPACN-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)propane-2-sulfonamide
SMILESCC(C)S(=O)(=O)Nc1ccccc1-c1cn2ccsc2n1
InChIInChI=1S/C14H15N3O2S2/c1-10(2)21(18,19)16-12-6-4-3-5-11(12)13-9-17-7-8-20-14(17)15-13/h3-10,16H,1-2H3
InChIKeyYUMJXFRHCXCUPB-UHFFFAOYSA-N
MW321.43 g/mol
LogP3.21
Rot. Bonds4

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

N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)propane-2-sulfonamide (PubChem CID 90626781) has the molecular formula C14H15N3O2S2 and a molecular weight of 321.43 g/mol. Its IUPAC name is N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)propane-2-sulfonamide.

Molecular Properties

Compound NameN-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)propane-2-sulfonamide
PubChem CID90626781
Molecular FormulaC14H15N3O2S2
Molecular Weight321.43 g/mol
Exact Mass321.06
IUPAC NameN-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)propane-2-sulfonamide
SMILESCC(C)S(=O)(=O)Nc1ccccc1-c1cn2ccsc2n1
InChIInChI=1S/C14H15N3O2S2/c1-10(2)21(18,19)16-12-6-4-3-5-11(12)13-9-17-7-8-20-14(17)15-13/h3-10,16H,1-2H3
InChIKeyYUMJXFRHCXCUPB-UHFFFAOYSA-N
XLogP3.21
TPSA63.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.43
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-chloro-N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)benzenesulfonamide
CID 90626756
3-chloro-N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-2-methylbenzenesulfonamide
CID 90626777
N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-4-phenoxybenzenesulfonamide
CID 90626747
(E)-N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)but-2-enamide
CID 90625813
6-(2-methylphenyl)imidazo[2,1-b][1,3]thiazole
CID 115403259
(2R)-N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-2-(3-methyl-6-oxopyridazin-1-yl)propanamide
CID 129410500
N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-2-naphthalen-1-yloxypropanamide
CID 90625958
2-fluoro-N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)benzamide
CID 90625740
N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3,4-dimethylbenzamide
CID 90625793
6-(2-fluorophenyl)imidazo[2,1-b][1,3]thiazole
CID 3528662
2-(4-bromophenyl)-N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)acetamide
CID 90625768
N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3-methyl-6-phenylimidazo[2,1-b][1,3]thiazole-2-carboxamide
CID 90626025

Frequently Asked Questions

What is the IUPAC name of N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)propane-2-sulfonamide?
The IUPAC name of N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)propane-2-sulfonamide (CID 90626781) is N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)propane-2-sulfonamide.
What is the SMILES notation for N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)propane-2-sulfonamide?
The canonical SMILES for N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)propane-2-sulfonamide is CC(C)S(=O)(=O)Nc1ccccc1-c1cn2ccsc2n1.
What is the InChIKey of N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)propane-2-sulfonamide?
The InChIKey is YUMJXFRHCXCUPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2S2/c1-10(2)21(18,19)16-12-6-4-3-5-11(12)13-9-17-7-8-20-14(17)15-13/h3-10,16H,1-2H3.
What are the key properties of N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)propane-2-sulfonamide?
N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)propane-2-sulfonamide has a molecular weight of 321.43 g/mol, XLogP of 3.21, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)propane-2-sulfonamide is sourced from PubChem (CID 90626781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).