Base information
| Cat. No. | |
| CAS No. | 201216-42-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C20H21N5O4 |
| Molecular Weight | 395.412 |
| Exact Mass | 395.159 |
| XLogP3 | 1.52418 |
| Mr | 114.065 |
| PSA | 130.65 |
| Sequence | - |
| Atom number | 50 |
| Bond number | 51 |
| Ring number | 3 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | OC(=O)/C=C\C(=O)O.C=CCN1CCN(CC1)c1nc2ccccc2nc1C#N |
