Base information
| Cat. No. | |
| CAS No. | 254451-42-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C49H71N7O8S2 |
| Molecular Weight | 950.26 |
| Exact Mass | 949.481 |
| XLogP3 | 10.5321 |
| Mr | 276.851 |
| PSA | 205.94 |
| Sequence | - |
| Atom number | 137 |
| Bond number | 138 |
| Ring number | 5 |
| Rotor number | 17 |
| Residues number | 0 |
| Canonical smiles | CC1=NN(C(=O)/C/1=C/C=C(\c1ccccc1)/C=C/c1c(C)nn(c1O)c1ccc(cc1)S(=O)(=O)O)c1ccc(cc1)S(=O)(=O)O.CCN(CC)CC.CCN(CC)CC.CCN(CC)CC |
