AC1ND6EF
7-(4-bromophenyl)-4-phenyl-1,4,8-triazatricyclo[6.3.0.02,6]undecane-3,5-dione
Also Known As: Oprea1_620362|AO-081/40770614|9-(4-bromophenyl)-2-phenylhexahydro-1H-pyrazolo[1,2-a]pyrrolo[3,4-c]pyrazole-1,3(2H)-dione|9-(4-bromophenyl)-2-phenyltetrahydro-5H-pyrazolo[1,2-a]pyrrolo[3,4-c]pyrazole-1,3(2H,3aH)-dione
CAS: 495385-36-9
| Molecular Formula | C20H18BrN3O2 |
|---|---|
| Molecular Weight | 411.05823 g/mol |
| LogP | 2.9847 |
| Topological Polar Surface Area | 43.86 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 411.05823 |
| Monoisotopic Mass | 411.05823 |
| Heavy Atoms | 26 |
| Complexity | 870.3848 |
Chemical Identifiers
| CAS Number | 495385-36-9 |
|---|---|
| SMILES | C1CN2C(C3C(N2C1)C(=O)N(C3=O)C4=CC=CC=C4)C5=CC=C(C=C5)Br |
Product Overview
AC1ND6EF (CAS 495385-36-9), with molecular formula C20H18BrN3O2 and molecular weight 411.05823 g/mol. IUPAC: 7-(4-bromophenyl)-4-phenyl-1,4,8-triazatricyclo[6.3.0.02,6]undecane-3,5-dione.
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.
View MSDS →
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