Base information
| Cat. No. | |
| CAS No. | 30896-57-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C17H13ClN4O |
| Molecular Weight | 324.764 |
| Exact Mass | 324.078 |
| XLogP3 | 2.5066 |
| Mr | 91.8128 |
| PSA | 63.3 |
| Sequence | - |
| Atom number | 36 |
| Bond number | 39 |
| Ring number | 4 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Clc1ccc2-n3c(C)nnc3C(N=C(c2c1)c1ccccc1)O |
