Base information
| Cat. No. | |
| CAS No. | 2179-16-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C20H21N7O6 |
| Molecular Weight | 455.424 |
| Exact Mass | 455.155 |
| XLogP3 | 1.5613 |
| Mr | 116.726 |
| PSA | 213.28 |
| Sequence | - |
| Atom number | 54 |
| Bond number | 56 |
| Ring number | 3 |
| Rotor number | 10 |
| Residues number | 0 |
| Canonical smiles | OC(=O)CC[C@@H](C(=O)O)NC(=O)c1ccc(cc1)NC(c1cnc2c(n1)c(=O)[nH]c(n2)N)C |
