Base information
| Cat. No. | |
| CAS No. | 2779-55-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H15N3O5 |
| Molecular Weight | 329.307 |
| Exact Mass | 329.101 |
| XLogP3 | 1.9518 |
| Mr | 85.3485 |
| PSA | 110.11 |
| Sequence | - |
| Atom number | 39 |
| Bond number | 40 |
| Ring number | 2 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | COc1c(OC)ccc(c1C(=O)O)C=NNC(=O)c1ccncc1 |
