Base information
| Cat. No. | |
| CAS No. | 110766-05-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C32H22N12 |
| Molecular Weight | 574.597 |
| Exact Mass | 574.209 |
| XLogP3 | 1.7586 |
| Mr | 172.052 |
| PSA | 171.02 |
| Sequence | - |
| Atom number | 66 |
| Bond number | 74 |
| Ring number | 9 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | [nH]1cnc(c1)/C/1=C/2\C=CC(=N2)/C(=c\2/cc/c(=C(/C3=N/C(=C(\c4[nH]c1cc4)/c1nc[nH]c1)/C=C3)\c1nc[nH]c1)/[nH]2)/c1nc[nH]c1 |
