Base information
| Cat. No. | |
| CAS No. | 110101-66-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C38H52N6O2 |
| Molecular Weight | 624.858 |
| Exact Mass | 624.415 |
| XLogP3 | 5.5912 |
| Mr | 198.525 |
| PSA | 72.88 |
| Sequence | - |
| Atom number | 98 |
| Bond number | 105 |
| Ring number | 8 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | O=C1C=C[C@]2(C(=C1)CC[C@@H]1C2=CC[C@]2([C@H]1C[C@H]([C@@H]2C(=O)CN1CCN(CC1)c1cc(nc(n1)N1CCCC1)N1CCCC1)C)C)C |
