3-{[(1-Azabicyclo[2.2.2]octan-3-yl)oxy]methyl}-10-butyl-10H-phenothiazine

Base Information

• Chemical Name: 3-{[(1-Azabicyclo[2.2.2]octan-3-yl)oxy]methyl}-10-butyl-10H-phenothiazine
• CAS No.: 182960-63-0
• Molecular Formula: C24H30N2OS
• Molecular Weight: 394.57300
• DSSTox Substance ID: DTXSID50596701
• Nikkaji Number: J2.088.855E
• Mol file: 182960-63-0.mol

Synonyms:182960-63-0;3-{[(1-Azabicyclo[2.2.2]octan-3-yl)oxy]methyl}-10-butyl-10H-phenothiazine;SCHEMBL8716678;DTXSID50596701

Chemical Property of 3-{[(1-Azabicyclo[2.2.2]octan-3-yl)oxy]methyl}-10-butyl-10H-phenothiazine

Chemical Property:

• Boiling Point: 537.4±50.0 °C(Predicted)
• PSA: 41.01000
• Density: 1.22±0.1 g/cm3(Predicted)
• LogP: 5.70310
• XLogP3: 5.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 394.20788476
• Heavy Atom Count: 28
• Complexity: 509

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCN1C2=C(C=C(C=C2)COC3CN4CCC3CC4)SC5=CC=CC=C51