Base information
| Cat. No. | |
| CAS No. | 101027-54-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C26H26ClN3O5 |
| Molecular Weight | 495.955 |
| Exact Mass | 495.156 |
| XLogP3 | 2.97628 |
| Mr | 133.293 |
| PSA | 113.54 |
| Sequence | - |
| Atom number | 61 |
| Bond number | 66 |
| Ring number | 7 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | [O-][Cl](=O)(=O)=O.N#CC1=c2cc3CCC[N+]4=c3c(c2Oc2c1cc1CCCN3c1c2CCC3)CCC4 |
