CID6212797
12-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraene
Also Known As: 12-[4-(2-phenylethenesulfonyl)piperazin-1-yl]-7-thia-9,11-diazatricyclo[6.4.0.0,2,6]dodeca-1(12),2(6),8,10-tetraene
CAS: 847792-08-9
| Molecular Formula | C21H22N4O2S2 |
|---|---|
| Molecular Weight | 426.1184 g/mol |
| LogP | 3.3027 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 426.1184 |
| Monoisotopic Mass | 426.1184 |
| Heavy Atoms | 29 |
| Complexity | 1164.1141 |
Chemical Identifiers
| CAS Number | 847792-08-9 |
|---|---|
| SMILES | C1CC2=C(C1)SC3=NC=NC(=C23)N4CCN(CC4)S(=O)(=O)/C=C/C5=CC=CC=C5 |
Product Overview
CID6212797 (CAS 847792-08-9), with molecular formula C21H22N4O2S2 and molecular weight 426.1184 g/mol. IUPAC: 12-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraene.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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