5-(4-Butoxy-1,2,5-thiadiazol-3-yl)-1-methyl-1,2,3,6-tetrahydropyridine

Base Information

• Chemical Name: 5-(4-Butoxy-1,2,5-thiadiazol-3-yl)-1-methyl-1,2,3,6-tetrahydropyridine
• CAS No.: 131986-35-1
• Molecular Formula: C12H19N3OS
• ChEMBL ID: CHEMBL101054
• DSSTox Substance ID: DTXSID40567268
• Nikkaji Number: J489.335B
• Pharos Ligand ID: D35DX9WR8BUF
• Wikidata: Q82453098

Synonyms:CHEMBL101054;131986-35-1;SCHEMBL6906658;DTXSID40567268;BDBM50003351;5-(4-Butoxy-1,2,5-thiadiazol-3-yl)-1-methyl-1,2,3,6-tetrahydropyridine;L004167;3-(4-butoxy-1,2,5-thiadiazol-3-yl)-1-methyl-1,2,5,6-tetrahydropyridine;5-(4-Butoxy-[1,2,5]thiadiazol-3-yl)-1-methyl-1,2,3,6-tetrahydro-pyridine;oxalic acid

Chemical Property of 5-(4-Butoxy-1,2,5-thiadiazol-3-yl)-1-methyl-1,2,3,6-tetrahydropyridine

Chemical Property:

• XLogP3: 2.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 253.12488341
• Heavy Atom Count: 17
• Complexity: 273

Purity/Quality:

99%, ^*data from raw suppliers

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCOC1=NSN=C1C2=CCCN(C2)C

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