Base information
| Cat. No. | |
| CAS No. | 80614-21-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C17H21N3O2 |
| Molecular Weight | 299.368 |
| Exact Mass | 299.163 |
| XLogP3 | 3.5547 |
| Mr | 86.0515 |
| PSA | 57.01 |
| Sequence | - |
| Atom number | 43 |
| Bond number | 44 |
| Ring number | 2 |
| Rotor number | 9 |
| Residues number | 0 |
| Canonical smiles | CCCCCC(OC(=O)c1cccnc1)/C=C/n1cncc1 |
