Base information
| Cat. No. | |
| CAS No. | 139756-03-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C17H22N4O3 |
| Molecular Weight | 330.382 |
| Exact Mass | 330.169 |
| XLogP3 | 2.8958 |
| Mr | 91.6771 |
| PSA | 99.24 |
| Sequence | - |
| Atom number | 46 |
| Bond number | 47 |
| Ring number | 2 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | CCCc1nn(c(c1NC(=O)c1ccccc1OCC)C(=O)N)C |