Base information
| Cat. No. | |
| CAS No. | 149733-79-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C17H20KN3O8S2 |
| Molecular Weight | 497.584 |
| Exact Mass | 497.033 |
| XLogP3 | 4.1339 |
| Mr | 111.396 |
| PSA | 214.92 |
| Sequence | - |
| Atom number | 51 |
| Bond number | 52 |
| Ring number | 3 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | NCCCCCN1C(=O)c2cc(cc3c2c(C1=O)cc(c3N)S(=O)(=O)O)S(=O)(=O)O.[KH] |
