((1R,2R)-2-((4-(Benzo[d]isothiazol-3-yl)piperazin-1-yl)methyl)cyclohexyl)methanamine

Base Information

• Chemical Name: ((1R,2R)-2-((4-(Benzo[d]isothiazol-3-yl)piperazin-1-yl)methyl)cyclohexyl)methanamine
• CAS No.: 1260138-03-1
• Molecular Formula: C19H28N4S
• Molecular Weight: 344.5
• Mol file: 1260138-03-1.mol

Synonyms:1260138-03-1;((1R,2R)-2-((4-(Benzo[d]isothiazol-3-yl)piperazin-1-yl)methyl)cyclohexyl)methanamine;SCHEMBL12908139;A936353

Chemical Property of ((1R,2R)-2-((4-(Benzo[d]isothiazol-3-yl)piperazin-1-yl)methyl)cyclohexyl)methanamine

Chemical Property:

• PKA: 10.27±0.29(Predicted)
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 344.20346808
• Heavy Atom Count: 24
• Complexity: 399

Purity/Quality:

NLT 98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1CCC(C(C1)CN)CN2CCN(CC2)C3=NSC4=CC=CC=C43
• Isomeric SMILES: C1CC[C@H]([C@@H](C1)CN)CN2CCN(CC2)C3=NSC4=CC=CC=C43