Base information
| Cat. No. | |
| CAS No. | 53826-89-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H5ClN2S |
| Molecular Weight | 172.635 |
| Exact Mass | 171.986 |
| XLogP3 | 1.8768 |
| Mr | 42.451 |
| PSA | 51.08 |
| Sequence | - |
| Atom number | 15 |
| Bond number | 16 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Clc1ncnc2c1CSC2 |
