Base information
| Cat. No. | |
| CAS No. | 223759-19-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C24H18NNaO12S3 |
| Molecular Weight | 631.584 |
| Exact Mass | 630.989 |
| XLogP3 | 8.2504 |
| Mr | 145.442 |
| PSA | 243.3 |
| Sequence | - |
| Atom number | 59 |
| Bond number | 62 |
| Ring number | 5 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | CC(c1ccccc1N(=O)=O)Oc1cc(c2c3c1ccc1c3c(cc2)c(cc1S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O.[NaH] |
