Base information
| Cat. No. | |
| CAS No. | 82354-19-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C31H29ClN2O6S2 |
| Molecular Weight | 625.155 |
| Exact Mass | 624.116 |
| XLogP3 | 5.2799 |
| Mr | 165.715 |
| PSA | 123.58 |
| Sequence | - |
| Atom number | 71 |
| Bond number | 78 |
| Ring number | 8 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | [O-]S(=O)(=O)c1cc(ccc1C1=c2cc3CCC[N+]4=c3c(c2Oc2c1cc1CCCN3c1c2CCC3)CCC4)S(=O)(=O)Cl |
