Base information
| Cat. No. | |
| CAS No. | 1416872-50-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C31H23N7O12 |
| Molecular Weight | 685.554 |
| Exact Mass | 685.14 |
| XLogP3 | 3.61352 |
| Mr | 157.267 |
| PSA | 260.54 |
| Sequence | - |
| Atom number | 73 |
| Bond number | 77 |
| Ring number | 5 |
| Rotor number | 16 |
| Residues number | 0 |
| Canonical smiles | [N-]=[N+]=Nc1ccc2c(c1)Oc1c(C32OC(=O)c2c3ccc(c2)C(=O)N(CC(=O)OCOC(=O)C)CC(=O)OCOC(=O)C)ccc(c1)N=[N+]=[N-] |
