Base information
| Cat. No. | |
| CAS No. | 161715-21-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H21N3O4S2 |
| Molecular Weight | 383.486 |
| Exact Mass | 383.097 |
| XLogP3 | -0.0283 |
| Mr | 109.045 |
| PSA | 144.04 |
| Sequence | - |
| Atom number | 46 |
| Bond number | 49 |
| Ring number | 4 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | C[C@H]([C@H]1C(=O)N2[C@@H]1[C@@H](C)C(=C2C(=O)O)SC1CN(C1)C1=NCCS1)O |
