Base information
| Cat. No. | |
| CAS No. | 4463-44-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C25H29N2NaO7S2 |
| Molecular Weight | 556.627 |
| Exact Mass | 556.131 |
| XLogP3 | 6.7518 |
| Mr | 142.03 |
| PSA | 170.12 |
| Sequence | - |
| Atom number | 66 |
| Bond number | 67 |
| Ring number | 3 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | CC/N=C\1/C=CC(=C(c2cc(O)c(cc2S(=O)(=O)O)S(=O)(=O)O)c2ccc(c(c2)C)NCC)C=C1C.[NaH] |
