Base information
| Cat. No. | |
| CAS No. | 100330-91-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C19H17N5O |
| Molecular Weight | 331.371 |
| Exact Mass | 331.143 |
| XLogP3 | 3.2442 |
| Mr | 98.8967 |
| PSA | 64.74 |
| Sequence | - |
| Atom number | 42 |
| Bond number | 45 |
| Ring number | 4 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | Cc1n(C)n(c(=O)c1Nc1ncnc2c1cccc2)c1ccccc1 |
