Base information
| Cat. No. | |
| CAS No. | 72830-39-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C19H21N5O3S |
| Molecular Weight | 399.467 |
| Exact Mass | 399.137 |
| XLogP3 | 2.5392 |
| Mr | 108.483 |
| PSA | 130.22 |
| Sequence | - |
| Atom number | 49 |
| Bond number | 52 |
| Ring number | 4 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | Cc1nc[nH]c1CSCCNc1ncc(c(=O)[nH]1)Cc1ccc2c(c1)OCO2 |
