Base information
| Cat. No. | |
| CAS No. | 5594-30-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C36H40N4O5 |
| Molecular Weight | 608.727 |
| Exact Mass | 608.3 |
| XLogP3 | 3.4676 |
| Mr | 183.431 |
| PSA | 125.64 |
| Sequence | - |
| Atom number | 85 |
| Bond number | 90 |
| Ring number | 6 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | COC(=O)[C@@H]1C2=C3C(=C(C(N3)C=c3[nH]c(=Cc4[nH]c(C=C5N=C2[C@@H](CCC(=O)OC)[C@@H]5C)c(C)c4C=C)c(c3CC)C)C)C1=O |
