Base information
| Cat. No. | |
| CAS No. | 146368-13-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C31H38N2O8S2 |
| Molecular Weight | 630.772 |
| Exact Mass | 630.207 |
| XLogP3 | 7.3018 |
| Mr | 172.962 |
| PSA | 171.88 |
| Sequence | - |
| Atom number | 81 |
| Bond number | 84 |
| Ring number | 4 |
| Rotor number | 11 |
| Residues number | 0 |
| Canonical smiles | CC[N+]1=C(C=CC=C2N(CCCCCC(=O)O)c3c(C2(C)C)cc(cc3)S(=O)(=O)O)C(c2c1ccc(c2)S(=O)(=O)[O-])(C)C |
