5,7-Dimethyl-2-(2-thienyl)-1,3-diazatricyclo[3.3.1.13,7]decane

Base Information

• Chemical Name: 5,7-Dimethyl-2-(2-thienyl)-1,3-diazatricyclo[3.3.1.13,7]decane
• CAS No.: 577762-09-5
• Molecular Formula: C14H20N2S
• Molecular Weight: 248.39
• DSSTox Substance ID: DTXSID00349805
• Wikidata: Q82125287
• ChEMBL ID: CHEMBL1610925
• Mol file: 577762-09-5.mol

Synonyms:577762-09-5;MLS000080296;HMS2392M24;5,7-DIMETHYL-2-(2-THIENYL)-1,3-DIAZATRICYCLO[3.3.1.13,7]DECANE;CHEMBL1610925;DTXSID00349805;AXSULNBQGJAEOG-UHFFFAOYSA-N;CCG-25366;STK778408;AKOS005618882;SMR000035051;SR-01000087410;SR-01000087410-1;5,7-dimethyl-2-(thiophen-2-yl)-1,3-diazatricyclo[3.3.1.1~3,7~]decane;5,7-DIMETHYL-2-(2-THIENYL)-1,3-DIAZATRICYCLO[3.3.1.1~3,7~]DECANE;Tricyclo[3.3.1.1(3,7)]decane, 5,7-dimethyl-2-(thiophen-2-yl)-1,3-diaza-

Chemical Property of 5,7-Dimethyl-2-(2-thienyl)-1,3-diazatricyclo[3.3.1.13,7]decane

Chemical Property:

• Boiling Point: 317.0±32.0 °C(Predicted)
• PKA: 6.32±0.70(Predicted)
• PSA: 34.72000
• Density: 1.22±0.1 g/cm3(Predicted)
• LogP: 2.67000
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 248.13471982
• Heavy Atom Count: 17
• Complexity: 307

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC12CC3(CN(C1)C(N(C2)C3)C4=CC=CS4)C