Base information
| Cat. No. | |
| CAS No. | 673474-74-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C64H94B2Br2N2O4 |
| Molecular Weight | 1136.87 |
| Exact Mass | 1134.58 |
| XLogP3 | 16.2144 |
| Mr | 328.67 |
| PSA | 43.4 |
| Sequence | - |
| Atom number | 168 |
| Bond number | 174 |
| Ring number | 8 |
| Rotor number | 24 |
| Residues number | 0 |
| Canonical smiles | CN(CCCC1(CCCN(C)C)c2cc(Br)ccc2-c2c1cc(Br)cc2)C.CCCCCCCCC1(CCCCCCCC)c2cc(ccc2-c2c1cc(cc2)B1OC(C(O1)(C)C)(C)C)B1OC(C(O1)(C)C)(C)C |
