Base information
| Cat. No. | |
| CAS No. | 12221-38-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C22H28ClN5O2S |
| Molecular Weight | 462.008 |
| Exact Mass | 461.165 |
| XLogP3 | 2.4288 |
| Mr | 129.528 |
| PSA | 112.4 |
| Sequence | - |
| Atom number | 59 |
| Bond number | 60 |
| Ring number | 3 |
| Rotor number | 10 |
| Residues number | 0 |
| Canonical smiles | CCOc1ccc2c(c1)sc([n+]2CCC(=O)N)/N=N/c1ccc(cc1)N(CC)CC.[Cl-] |
