Base information
| Cat. No. | |
| CAS No. | 1400191-52-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C25H23N2NaO8S |
| Molecular Weight | 534.513 |
| Exact Mass | 534.107 |
| XLogP3 | 3.1631 |
| Mr | 135.544 |
| PSA | 146.74 |
| Sequence | - |
| Atom number | 60 |
| Bond number | 62 |
| Ring number | 4 |
| Rotor number | 9 |
| Residues number | 0 |
| Canonical smiles | O=C(ON1C(=O)CC(C1=O)S(=O)(=O)O)CCCCC(=O)N1Cc2ccccc2C#Cc2c1cccc2.[NaH] |
