Base information
| Cat. No. | |
| CAS No. | 1206161-97-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H23N5O3S |
| Molecular Weight | 425.504 |
| Exact Mass | 425.152 |
| XLogP3 | 3.0669 |
| Mr | 118.091 |
| PSA | 105.05 |
| Sequence | - |
| Atom number | 53 |
| Bond number | 57 |
| Ring number | 5 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | O=C(C1CC1)Nc1nc2n(n1)c(ccc2)c1ccc(cc1)CN1CCS(=O)(=O)CC1 |
