Timepidium

Base Information

• Chemical Name: Timepidium
• CAS No.: 97094-64-9
• Molecular Formula: C17H22 N O S2
• Molecular Weight: 0
• UNII: C1WS2XH3K4
• DSSTox Substance ID: DTXSID8048284
• Nikkaji Number: J238.076E
• Wikidata: Q27275072
• NCI Thesaurus Code: C87647
• Metabolomics Workbench ID: 154628
• ChEMBL ID: CHEMBL1865135
• Mol file: 97094-64-9.mol

Synonyms:Timepidium;Timepidium ion;Timepidium cation;97094-64-9;UNII-C1WS2XH3K4;mepidium;C1WS2XH3K4;3-(Di-2-thienylmethylene)-5-methoxy-1,1-dimethyl-piperidinium;Piperidinium,3-(di-2-thienylmethylene)-5-methoxy-1,1-dimethyl-, bromide (1:1);3-(Di(thiophen-2-yl)methylene)-5-methoxy-1,1-dimethylpiperidin-1-ium;NCGC00181009-01;3-(Di-2-thienylmethylene)-5-methoxy-1,1-dimethylpiperidinium bromide;TIMEPIDIUM [WHO-DD];SCHEMBL250086;SA 50Y;CHEMBL1865135;DTXSID8048284;3-[bis(2-thienyl)methylene]-5-methoxy-1,1-dimethyl-piperidin-1-ium;AKOS015962124;DB13850;Q27275072;Piperidinium, 3-(di-2-thienylmethylene)-5-methoxy-1,1-dimethyl-;Piperidinium, 3-(di-2-thienylmethylene)-5-methoxy-1,1-dimethyl-, bromide3-(Di-2-thienylmethylene)-5-methoxy-1,1-dimethylpiperidinium bromide

Chemical Property of Timepidium

Chemical Property:

• PSA: 65.71000
• LogP: 4.06540
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 320.11428167
• Heavy Atom Count: 21
• Complexity: 390

Purity/Quality:

TIMEPIDIUM 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C[N+]1(CC(CC(=C(C2=CC=CS2)C3=CC=CS3)C1)OC)C