Base information
| Cat. No. | |
| CAS No. | 1315481-36-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C25H27N9O8S2 |
| Molecular Weight | 645.667 |
| Exact Mass | 645.142 |
| XLogP3 | -0.5165 |
| Mr | 164.194 |
| PSA | 270.86 |
| Sequence | - |
| Atom number | 71 |
| Bond number | 75 |
| Ring number | 5 |
| Rotor number | 12 |
| Residues number | 0 |
| Canonical smiles | CCN1CCN(C(=O)C1=O)C(=O)N[C@H](c1ccc(cc1)O)C(=O)N[C@H]1C(=O)N2[C@@H]1SCC(=C2C(=O)O)CSc1nnnn1C |
