Base information
| Cat. No. | |
| CAS No. | 1031727-28-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C22H23N3O4 |
| Molecular Weight | 393.436 |
| Exact Mass | 393.169 |
| XLogP3 | 1.9644 |
| Mr | 117.333 |
| PSA | 78.95 |
| Sequence | - |
| Atom number | 52 |
| Bond number | 56 |
| Ring number | 5 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COc1ccc2c(c1)NC(=O)[C@]12C=C2N([C@H]1C=C(C)C)C(=O)[C@H]1N(C2=O)CCC1 |
