Base information
| Cat. No. | |
| CAS No. | 1028385-32-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C37H31N5O4S |
| Molecular Weight | 641.738 |
| Exact Mass | 641.21 |
| XLogP3 | 8.21628 |
| Mr | 185.121 |
| PSA | 139.25 |
| Sequence | - |
| Atom number | 78 |
| Bond number | 83 |
| Ring number | 7 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | Cc1ccc(cc1)S(=O)(=O)O.N#CC(c1ccc(cc1)n1c(=O)n(c2c1c1cc(ccc1nc2)c1cnc2c(c1)cccc2)C)(C)C |
