Base information
| Cat. No. | |
| CAS No. | 160296-13-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C17H18N2O3S |
| Molecular Weight | 330.401 |
| Exact Mass | 330.104 |
| XLogP3 | 2.7978 |
| Mr | 91.4467 |
| PSA | 113.68 |
| Sequence | - |
| Atom number | 41 |
| Bond number | 43 |
| Ring number | 3 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | CC#CCOC(=O)c1c(C)nc2c(c1N)c1CCC(Cc1s2)O |
