Base information
| Cat. No. | |
| CAS No. | 60126-86-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C17H17IN2S |
| Molecular Weight | 408.3 |
| Exact Mass | 408.016 |
| XLogP3 | 1.3685 |
| Mr | 103.161 |
| PSA | 44.15 |
| Sequence | - |
| Atom number | 38 |
| Bond number | 39 |
| Ring number | 3 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CC[n+]1c(/C=C/Nc2ccccc2)sc2c1cccc2.[I-] |
