N-(4-acetylphenyl)-2-methyl-6-propan-2-ylimidazo[2,1-b][1,3]thiazole-5-sulfonamide

C17H19N3O3S2 — CID 53151679

IUPACN-(4-acetylphenyl)-2-methyl-6-propan-2-ylimidazo[2,1-b][1,3]thiazole-5-sulfonamide
SMILESCC(=O)c1ccc(NS(=O)(=O)c2c(C(C)C)nc3sc(C)cn23)cc1
InChIInChI=1S/C17H19N3O3S2/c1-10(2)15-16(20-9-11(3)24-17(20)18-15)25(22,23)19-14-7-5-13(6-8-14)12(4)21/h5-10,19H,1-4H3
InChIKeySQLVGGBPTXBDKU-UHFFFAOYSA-N
MW377.49 g/mol
LogP3.83
Rot. Bonds5

About N-(4-acetylphenyl)-2-methyl-6-propan-2-ylimidazo[2,1-b][1,3]thiazole-5-sulfonamide

N-(4-acetylphenyl)-2-methyl-6-propan-2-ylimidazo[2,1-b][1,3]thiazole-5-sulfonamide (PubChem CID 53151679) has the molecular formula C17H19N3O3S2 and a molecular weight of 377.49 g/mol. Its IUPAC name is N-(4-acetylphenyl)-2-methyl-6-propan-2-ylimidazo[2,1-b][1,3]thiazole-5-sulfonamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-2-methyl-6-propan-2-ylimidazo[2,1-b][1,3]thiazole-5-sulfonamide
PubChem CID53151679
Molecular FormulaC17H19N3O3S2
Molecular Weight377.49 g/mol
Exact Mass377.09
IUPAC NameN-(4-acetylphenyl)-2-methyl-6-propan-2-ylimidazo[2,1-b][1,3]thiazole-5-sulfonamide
SMILESCC(=O)c1ccc(NS(=O)(=O)c2c(C(C)C)nc3sc(C)cn23)cc1
InChIInChI=1S/C17H19N3O3S2/c1-10(2)15-16(20-9-11(3)24-17(20)18-15)25(22,23)19-14-7-5-13(6-8-14)12(4)21/h5-10,19H,1-4H3
InChIKeySQLVGGBPTXBDKU-UHFFFAOYSA-N
XLogP3.83
TPSA80.54 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.49
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(3,4-dimethylphenyl)-2-methyl-6-propan-2-ylimidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 53151706
2-methyl-N-phenyl-6-propan-2-ylimidazo[2,1-b][1,3,4]thiadiazole-5-sulfonamide
CID 53152162
2-methyl-5-(4-phenylpiperazin-1-yl)sulfonyl-6-propan-2-ylimidazo[2,1-b][1,3]thiazole
CID 53151698
N-(4-acetylphenyl)-5-fluorothiophene-2-sulfonamide
CID 91969494
methyl 3-[[2,6-di(propan-2-yl)imidazo[2,1-b][1,3,4]thiadiazol-5-yl]sulfonylamino]benzoate
CID 53152235
N-(4-acetylphenyl)-1,3,5-trimethylpyrazole-4-sulfonamide
CID 8822254
N-(4-acetylphenyl)-3,5-difluorobenzenesulfonamide
CID 51170160
N-(4-acetylphenyl)-1-propan-2-yl-3-thiophen-2-ylpyrazole-4-sulfonamide
CID 42285268
propan-2-yl 4-[(4-acetylphenyl)sulfonylamino]benzoate
CID 7938904
methyl 4-[(6-ethyl-2-propan-2-ylimidazo[2,1-b][1,3,4]thiadiazol-5-yl)sulfonylamino]benzoate
CID 53152182
1-[4-[(4-acetylphenyl)sulfamoylsulfamoylamino]phenyl]ethanone
CID 12781230
1-[4-[(2-bromoimidazo[2,1-b][1,3,4]thiadiazol-6-yl)methylamino]phenyl]ethanone
CID 67336252

Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-2-methyl-6-propan-2-ylimidazo[2,1-b][1,3]thiazole-5-sulfonamide?
The IUPAC name of N-(4-acetylphenyl)-2-methyl-6-propan-2-ylimidazo[2,1-b][1,3]thiazole-5-sulfonamide (CID 53151679) is N-(4-acetylphenyl)-2-methyl-6-propan-2-ylimidazo[2,1-b][1,3]thiazole-5-sulfonamide.
What is the SMILES notation for N-(4-acetylphenyl)-2-methyl-6-propan-2-ylimidazo[2,1-b][1,3]thiazole-5-sulfonamide?
The canonical SMILES for N-(4-acetylphenyl)-2-methyl-6-propan-2-ylimidazo[2,1-b][1,3]thiazole-5-sulfonamide is CC(=O)c1ccc(NS(=O)(=O)c2c(C(C)C)nc3sc(C)cn23)cc1.
What is the InChIKey of N-(4-acetylphenyl)-2-methyl-6-propan-2-ylimidazo[2,1-b][1,3]thiazole-5-sulfonamide?
The InChIKey is SQLVGGBPTXBDKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O3S2/c1-10(2)15-16(20-9-11(3)24-17(20)18-15)25(22,23)19-14-7-5-13(6-8-14)12(4)21/h5-10,19H,1-4H3.
What are the key properties of N-(4-acetylphenyl)-2-methyl-6-propan-2-ylimidazo[2,1-b][1,3]thiazole-5-sulfonamide?
N-(4-acetylphenyl)-2-methyl-6-propan-2-ylimidazo[2,1-b][1,3]thiazole-5-sulfonamide has a molecular weight of 377.49 g/mol, XLogP of 3.83, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-2-methyl-6-propan-2-ylimidazo[2,1-b][1,3]thiazole-5-sulfonamide is sourced from PubChem (CID 53151679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).