Base information
| Cat. No. | |
| CAS No. | 125299-79-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C44H22Br8N4O4 |
| Molecular Weight | 1309.9 |
| Exact Mass | 1301.51 |
| XLogP3 | 11.7886 |
| Mr | 273.161 |
| PSA | 137.22 |
| Sequence | - |
| Atom number | 82 |
| Bond number | 90 |
| Ring number | 9 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | Brc1cc(cc(c1O)Br)/C/1=C/2\C=CC(=N2)/C(=c\2/cc/c(=C(/C3=N/C(=C(\c4[nH]c1cc4)/c1cc(Br)c(c(c1)Br)O)/C=C3)\c1cc(Br)c(c(c1)Br)O)/[nH]2)/c1cc(Br)c(c(c1)Br)O |
