Base information
| Cat. No. | |
| CAS No. | 1246815-57-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C20H17D8N3S |
| Molecular Weight | 347.547 |
| Exact Mass | 347.227 |
| XLogP3 | 3.8676 |
| Mr | 113.102 |
| PSA | 35.02 |
| Sequence | - |
| Atom number | 49 |
| Bond number | 52 |
| Ring number | 4 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CN1C([2H])([2H])C([2H])([2H])N(C(C1([2H])[2H])([2H])[2H])CCCN1c2ccccc2Sc2c1cccc2 |
