Base information
| Cat. No. | |
| CAS No. | 1821143-79-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H13NO |
| Molecular Weight | 259.302 |
| Exact Mass | 259.1 |
| XLogP3 | 4.1309 |
| Mr | 81.5495 |
| PSA | 29.96 |
| Sequence | - |
| Atom number | 33 |
| Bond number | 35 |
| Ring number | 3 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | O=C(c1cccnc1)/C=C/c1ccc2c(c1)cccc2 |
