Base information
| Cat. No. | |
| CAS No. | 635698-34-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H13N3O2 |
| Molecular Weight | 243.261 |
| Exact Mass | 243.101 |
| XLogP3 | 0.5169 |
| Mr | 71.6064 |
| PSA | 68.96 |
| Sequence | - |
| Atom number | 31 |
| Bond number | 33 |
| Ring number | 3 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | O=c1[nH]c2CN(Cc2c(=O)[nH]1)Cc1ccccc1 |
