6-chloro-N-methoxy-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide

C7H8ClN3O3S2 — CID 61052679

IUPAC6-chloro-N-methoxy-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide
SMILESCON(C)S(=O)(=O)c1c(Cl)nc2sccn12
InChIInChI=1S/C7H8ClN3O3S2/c1-10(14-2)16(12,13)6-5(8)9-7-11(6)3-4-15-7/h3-4H,1-2H3
InChIKeyYZRKLYQWOVVRBO-UHFFFAOYSA-N
MW281.75 g/mol
LogP1.23
Rot. Bonds3

About 6-chloro-N-methoxy-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide

6-chloro-N-methoxy-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide (PubChem CID 61052679) has the molecular formula C7H8ClN3O3S2 and a molecular weight of 281.75 g/mol. Its IUPAC name is 6-chloro-N-methoxy-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide.

Molecular Properties

Compound Name6-chloro-N-methoxy-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide
PubChem CID61052679
Molecular FormulaC7H8ClN3O3S2
Molecular Weight281.75 g/mol
Exact Mass280.97
IUPAC Name6-chloro-N-methoxy-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide
SMILESCON(C)S(=O)(=O)c1c(Cl)nc2sccn12
InChIInChI=1S/C7H8ClN3O3S2/c1-10(14-2)16(12,13)6-5(8)9-7-11(6)3-4-15-7/h3-4H,1-2H3
InChIKeyYZRKLYQWOVVRBO-UHFFFAOYSA-N
XLogP1.23
TPSA63.91 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.75
LogP ≤ 51.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

6-chloro-N-methyl-N-(1-methylpiperidin-4-yl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 60812795
2-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonyl-methylamino]acetamide
CID 60813305
6-chloro-N-(2-methoxyethyl)-N-propan-2-ylimidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 82948195
6-chloro-N-(4-hydroxyphenyl)-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 106831846
6-chloro-N-(5-hydroxypentyl)-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 107199118
6-chloro-N-(2-methoxyethoxy)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 114009664
methyl 2-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]-2-methylpropanoate
CID 61051278
6-chloro-N-[3-(dimethylamino)propyl]imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 60812798
6-chloro-N-methyl-N-(3-methylcyclohexyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 61446970
6-chloro-N-(furan-3-ylmethyl)-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 61422810
6-chloro-N-methyl-N-(4-methylsulfanylbutan-2-yl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 115638895
6-chloro-N-(3-hydroxypropyl)-N-propan-2-ylimidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 61047458

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-methoxy-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide?
The IUPAC name of 6-chloro-N-methoxy-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide (CID 61052679) is 6-chloro-N-methoxy-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide.
What is the SMILES notation for 6-chloro-N-methoxy-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide?
The canonical SMILES for 6-chloro-N-methoxy-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide is CON(C)S(=O)(=O)c1c(Cl)nc2sccn12.
What is the InChIKey of 6-chloro-N-methoxy-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide?
The InChIKey is YZRKLYQWOVVRBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8ClN3O3S2/c1-10(14-2)16(12,13)6-5(8)9-7-11(6)3-4-15-7/h3-4H,1-2H3.
What are the key properties of 6-chloro-N-methoxy-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide?
6-chloro-N-methoxy-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide has a molecular weight of 281.75 g/mol, XLogP of 1.23, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-methoxy-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide is sourced from PubChem (CID 61052679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).