Base information
| Cat. No. | |
| CAS No. | 148858-09-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H13N3O2 |
| Molecular Weight | 243.261 |
| Exact Mass | 243.101 |
| XLogP3 | 2.1125 |
| Mr | 69.9362 |
| PSA | 56.15 |
| Sequence | - |
| Atom number | 31 |
| Bond number | 33 |
| Ring number | 3 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | CCOC(=O)c1ncn2-c3c(NCc12)cccc3 |