Base information
| Cat. No. | |
| CAS No. | 2101661-88-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C46H58N8O13 |
| Molecular Weight | 930.999 |
| Exact Mass | 930.412 |
| XLogP3 | 8.0223 |
| Mr | 244.527 |
| PSA | 251.22 |
| Sequence | - |
| Atom number | 125 |
| Bond number | 129 |
| Ring number | 5 |
| Rotor number | 26 |
| Residues number | 0 |
| Canonical smiles | O=C(OCC1c2ccccc2-c2c1cccc2)NCCN(C(=O)Cn1cnc2c1nc(nc2N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)CC(=O)O |
