4-methoxy-N-[(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]benzenesulfonamide

C14H15N3O3S2 — CID 23603678

IUPAC4-methoxy-N-[(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]benzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)NCc2cn3c(C)csc3n2)cc1
InChIInChI=1S/C14H15N3O3S2/c1-10-9-21-14-16-11(8-17(10)14)7-15-22(18,19)13-5-3-12(20-2)4-6-13/h3-6,8-9,15H,7H2,1-2H3
InChIKeyDCSPIBVBGBFIDE-UHFFFAOYSA-N
MW337.43 g/mol
LogP2.19
Rot. Bonds5

About 4-methoxy-N-[(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]benzenesulfonamide

4-methoxy-N-[(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]benzenesulfonamide (PubChem CID 23603678) has the molecular formula C14H15N3O3S2 and a molecular weight of 337.43 g/mol. Its IUPAC name is 4-methoxy-N-[(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]benzenesulfonamide.

Molecular Properties

Compound Name4-methoxy-N-[(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]benzenesulfonamide
PubChem CID23603678
Molecular FormulaC14H15N3O3S2
Molecular Weight337.43 g/mol
Exact Mass337.06
IUPAC Name4-methoxy-N-[(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]benzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)NCc2cn3c(C)csc3n2)cc1
InChIInChI=1S/C14H15N3O3S2/c1-10-9-21-14-16-11(8-17(10)14)7-15-22(18,19)13-5-3-12(20-2)4-6-13/h3-6,8-9,15H,7H2,1-2H3
InChIKeyDCSPIBVBGBFIDE-UHFFFAOYSA-N
XLogP2.19
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.43
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-methoxy-N-[(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]benzenesulfonamide with MolForge

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Related Compounds

3-fluoro-4-methoxy-N-[(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]benzenesulfonamide
CID 5310095
N-[(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]pyridine-3-sulfonamide
CID 3244249
N-[(2,6-dimethylimidazo[2,1-b][1,3,4]thiadiazol-5-yl)methyl]-4-methoxybenzenesulfonamide
CID 53163237
4-ethoxy-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)benzenesulfonamide
CID 23603672
4-methoxy-N-[(2-methyl-6-phenylimidazo[2,1-b][1,3,4]thiadiazol-5-yl)methyl]benzenesulfonamide
CID 53163162
N-(2-amino-2-methylpropyl)-4-methoxybenzenesulfonamide
CID 115303620
4-butoxy-N-[(2-methyl-1,3-thiazol-4-yl)methyl]benzenesulfonamide
CID 3245366
N-benzyl-4-methoxybenzenesulfonamide
CID 741351
4-methoxy-N-[6-(4-methylphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl]benzenesulfonamide
CID 108780595
4-methoxy-N-[3-[(4-methoxyphenyl)sulfonylamino]propyl]benzenesulfonamide
CID 2164945
N-[(5-amino-1,3,4-thiadiazol-2-yl)methyl]-4-methoxybenzenesulfonamide
CID 92659524
N-[(2-amino-1,3-thiazol-4-yl)methyl]-4-ethoxybenzenesulfonamide
CID 110718117

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]benzenesulfonamide?
The IUPAC name of 4-methoxy-N-[(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]benzenesulfonamide (CID 23603678) is 4-methoxy-N-[(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]benzenesulfonamide.
What is the SMILES notation for 4-methoxy-N-[(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]benzenesulfonamide?
The canonical SMILES for 4-methoxy-N-[(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]benzenesulfonamide is COc1ccc(S(=O)(=O)NCc2cn3c(C)csc3n2)cc1.
What is the InChIKey of 4-methoxy-N-[(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]benzenesulfonamide?
The InChIKey is DCSPIBVBGBFIDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O3S2/c1-10-9-21-14-16-11(8-17(10)14)7-15-22(18,19)13-5-3-12(20-2)4-6-13/h3-6,8-9,15H,7H2,1-2H3.
What are the key properties of 4-methoxy-N-[(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]benzenesulfonamide?
4-methoxy-N-[(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]benzenesulfonamide has a molecular weight of 337.43 g/mol, XLogP of 2.19, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)methyl]benzenesulfonamide is sourced from PubChem (CID 23603678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).