Base information
| Cat. No. | |
| CAS No. | 1177-81-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C19H18ClN3O7 |
| Molecular Weight | 435.815 |
| Exact Mass | 435.083 |
| XLogP3 | 1.4098 |
| Mr | 103.999 |
| PSA | 199.69 |
| Sequence | - |
| Atom number | 48 |
| Bond number | 51 |
| Ring number | 4 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | NN=C1C(=C(C(=O)N)C(=O)C2(C1CC1C(=C2O)Cc2c(C1O)c(Cl)ccc2O)O)O |
