Base information
| Cat. No. | |
| CAS No. | 704910-89-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H17N3OS |
| Molecular Weight | 299.391 |
| Exact Mass | 299.109 |
| XLogP3 | 3.8756 |
| Mr | 86.5207 |
| PSA | 76.1 |
| Sequence | - |
| Atom number | 38 |
| Bond number | 40 |
| Ring number | 3 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | COc1ccc2c(c1)[nH]c(n2)SCc1ncc(cc1C)C |
