Base information
| Cat. No. | |
| CAS No. | 21561-09-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H15N3O2 |
| Molecular Weight | 281.309 |
| Exact Mass | 281.116 |
| XLogP3 | 3.4636 |
| Mr | 82.0657 |
| PSA | 56.27 |
| Sequence | - |
| Atom number | 36 |
| Bond number | 38 |
| Ring number | 3 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | COc1cc2c(ncnc2cc1OC)Nc1ccccc1 |
