Base information
| Cat. No. | |
| CAS No. | 12219-30-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C40H32N3NaO8S2 |
| Molecular Weight | 769.817 |
| Exact Mass | 769.153 |
| XLogP3 | 10.5412 |
| Mr | 207.336 |
| PSA | 195.28 |
| Sequence | - |
| Atom number | 86 |
| Bond number | 91 |
| Ring number | 7 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | Cn1c2ccccc2c(c1c1ccccc1)C(=C1C=C/C(=N/c2ccc(c(c2)S(=O)(=O)O)O)/C=C1)c1ccc(cc1)Nc1ccc(c(c1)S(=O)(=O)O)O.[NaH] |
