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

C13H14N4O2S2 — CID 62142991

IUPAC6-amino-N-(2,3-dimethylphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
SMILESCc1cccc(NS(=O)(=O)c2c(N)nc3sccn23)c1C
InChIInChI=1S/C13H14N4O2S2/c1-8-4-3-5-10(9(8)2)16-21(18,19)12-11(14)15-13-17(12)6-7-20-13/h3-7,16H,14H2,1-2H3
InChIKeyJHBRVLMSGXCCTE-UHFFFAOYSA-N
MW322.42 g/mol
LogP2.40
Rot. Bonds3

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

6-amino-N-(2,3-dimethylphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide (PubChem CID 62142991) has the molecular formula C13H14N4O2S2 and a molecular weight of 322.42 g/mol. Its IUPAC name is 6-amino-N-(2,3-dimethylphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide.

Molecular Properties

Compound Name6-amino-N-(2,3-dimethylphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
PubChem CID62142991
Molecular FormulaC13H14N4O2S2
Molecular Weight322.42 g/mol
Exact Mass322.06
IUPAC Name6-amino-N-(2,3-dimethylphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
SMILESCc1cccc(NS(=O)(=O)c2c(N)nc3sccn23)c1C
InChIInChI=1S/C13H14N4O2S2/c1-8-4-3-5-10(9(8)2)16-21(18,19)12-11(14)15-13-17(12)6-7-20-13/h3-7,16H,14H2,1-2H3
InChIKeyJHBRVLMSGXCCTE-UHFFFAOYSA-N
XLogP2.40
TPSA89.49 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.42
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

6-amino-N-(3-fluoro-2-methylphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 62157983
6-amino-N-(4-methyl-3-pyridinyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 63328389
6-amino-N-(2-bromo-3-chlorophenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 103481342
6-amino-N-(4-methylphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 62144732
6-amino-N-(2,4-dibromophenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 62151548
6-amino-N-(4-bromo-3-methylphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 62150268
6-amino-N-(5-bromo-4-methyl-2-pyridinyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 79736649
6-amino-N-(1,3,4-thiadiazol-2-yl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 62163150
2-[(6-aminoimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]propanamide
CID 62146624
6-amino-N-(3,5-difluorophenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 62142801
2-amino-N-(2-methylphenyl)imidazo[1,2-a]pyridine-3-sulfonamide
CID 62145093
6-chloro-N-(2-hydroxyphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 103739497

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-(2,3-dimethylphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide?
The IUPAC name of 6-amino-N-(2,3-dimethylphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide (CID 62142991) is 6-amino-N-(2,3-dimethylphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide.
What is the SMILES notation for 6-amino-N-(2,3-dimethylphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide?
The canonical SMILES for 6-amino-N-(2,3-dimethylphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide is Cc1cccc(NS(=O)(=O)c2c(N)nc3sccn23)c1C.
What is the InChIKey of 6-amino-N-(2,3-dimethylphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide?
The InChIKey is JHBRVLMSGXCCTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O2S2/c1-8-4-3-5-10(9(8)2)16-21(18,19)12-11(14)15-13-17(12)6-7-20-13/h3-7,16H,14H2,1-2H3.
What are the key properties of 6-amino-N-(2,3-dimethylphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide?
6-amino-N-(2,3-dimethylphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide has a molecular weight of 322.42 g/mol, XLogP of 2.40, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(2,3-dimethylphenyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide is sourced from PubChem (CID 62142991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).