Base information
| Cat. No. | |
| CAS No. | 15664-29-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C35H36N4O5 |
| Molecular Weight | 592.684 |
| Exact Mass | 592.269 |
| XLogP3 | 3.5389 |
| Mr | 180.419 |
| PSA | 136.97 |
| Sequence | - |
| Atom number | 80 |
| Bond number | 85 |
| Ring number | 6 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | COC(=O)[C@H]1C(=O)c2c3=C1C1=N/C(=C\c4[nH]c(c(c4C)C=C)/C=C/4\N=C(/C=c(/c2C)\[nH]3)C(=C4C)CC)/[C@H]([C@@H]1CCC(=O)O)C |
