Base information
| Cat. No. | |
| CAS No. | 4921-86-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H11N3OS |
| Molecular Weight | 257.311 |
| Exact Mass | 257.062 |
| XLogP3 | 2.6723 |
| Mr | 73.8509 |
| PSA | 86.11 |
| Sequence | - |
| Atom number | 29 |
| Bond number | 30 |
| Ring number | 2 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | S=C(NC(=O)c1ccccc1)Nc1ccccn1 |
