Base information
| Cat. No. | |
| CAS No. | 67699-40-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C48H58ClN5O9 |
| Molecular Weight | 884.455 |
| Exact Mass | 883.392 |
| XLogP3 | 4.9219 |
| Mr | 251.059 |
| PSA | 154.18 |
| Sequence | - |
| Atom number | 121 |
| Bond number | 130 |
| Ring number | 10 |
| Rotor number | 10 |
| Residues number | 0 |
| Canonical smiles | ClCCN1C(=O)O[C@@]2(C1=O)[C@@H]1N(C)c3c([C@]41CCN1[C@H]4[C@@]([C@H]2OC(=O)C)(CC)C=CC1)cc(c(c3)OC)[C@]1(C[C@@H]2CN(CCc3c1[nH]c1c3cccc1)C[C@](C2)(O)CC)C(=O)OC |
