Base information
| Cat. No. | |
| CAS No. | 2095485-22-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H13NO3S |
| Molecular Weight | 263.312 |
| Exact Mass | 263.062 |
| XLogP3 | 2.5783 |
| Mr | 73.2115 |
| PSA | 62.83 |
| Sequence | - |
| Atom number | 31 |
| Bond number | 32 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | C#CCCCN1c2ccccc2C(=O)CS1(=O)=O |
