Base information
| Cat. No. | |
| CAS No. | 115970-66-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C38H48ClN2NaO6S2 |
| Molecular Weight | 751.37 |
| Exact Mass | 750.254 |
| XLogP3 | 10.1952 |
| Mr | 209.039 |
| PSA | 134.58 |
| Sequence | - |
| Atom number | 98 |
| Bond number | 101 |
| Ring number | 5 |
| Rotor number | 13 |
| Residues number | 0 |
| Canonical smiles | ClC1=C(CCCC1=CC=C1N(CCCCS(=O)(=O)O)c2c(C1(C)C)cccc2)C=CC1=[N+](CCCCS(=O)(=O)[O-])c2c(C1(C)C)cccc2.[NaH] |
