Base information
| Cat. No. | |
| CAS No. | 196391-62-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C43H53N8O7P |
| Molecular Weight | 824.904 |
| Exact Mass | 824.377 |
| XLogP3 | 7.31558 |
| Mr | 227.604 |
| PSA | 175.17 |
| Sequence | - |
| Atom number | 112 |
| Bond number | 117 |
| Ring number | 6 |
| Rotor number | 19 |
| Residues number | 0 |
| Canonical smiles | N#CCCOP(N(C(C)C)C(C)C)O[C@@H]1C[C@H](O[C@H]1n1cnc2c1nc(/N=C/N(C)C)[nH]c2=O)COC(c1ccc(cc1)OC)(c1ccc(cc1)OC)c1ccccc1 |
