Base information
| Cat. No. | |
| CAS No. | 55750-06-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C22H26N6O3 |
| Molecular Weight | 422.48 |
| Exact Mass | 422.207 |
| XLogP3 | 2.186 |
| Mr | 135.858 |
| PSA | 127.21 |
| Sequence | - |
| Atom number | 57 |
| Bond number | 59 |
| Ring number | 4 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | O=C(Nc1cccc(c1)C1=NCCN1)Nc1cccc(c1)C1=NCCN1.CCC(=O)O |
