Base information
| Cat. No. | |
| CAS No. | 10360-31-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H16N3NaO3S3 |
| Molecular Weight | 477.555 |
| Exact Mass | 477.025 |
| XLogP3 | 7.1518 |
| Mr | 124.011 |
| PSA | 171.03 |
| Sequence | - |
| Atom number | 47 |
| Bond number | 50 |
| Ring number | 5 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | Nc1ccc(cc1)c1nc2c(s1)cc(cc2)c1nc2c(s1)c(c(cc2)C)S(=O)(=O)O.[NaH] |
