Base information
| Cat. No. | |
| CAS No. | 220446-74-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H14F4N5NaO8S3 |
| Molecular Weight | 599.489 |
| Exact Mass | 598.984 |
| XLogP3 | 3.13446 |
| Mr | 116.476 |
| PSA | 255.88 |
| Sequence | - |
| Atom number | 51 |
| Bond number | 51 |
| Ring number | 2 |
| Rotor number | 13 |
| Residues number | 0 |
| Canonical smiles | [N-]=[N+]=Nc1c(F)c(F)c(c(c1F)F)C(=O)NCCSSCCC(=O)ON1C(=O)CC(C1=O)S(=O)(=O)O.[NaH] |
