Base information
| Cat. No. | |
| CAS No. | 1392312-45-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C42H62N2O4S |
| Molecular Weight | 691.018 |
| Exact Mass | 690.443 |
| XLogP3 | 9.5177 |
| Mr | 206.54 |
| PSA | 95.09 |
| Sequence | - |
| Atom number | 111 |
| Bond number | 117 |
| Ring number | 7 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | CC(=C)[C@@H]1CC[C@]2([C@H]1[C@H]1CC[C@H]3[C@@]([C@]1(C)CC2)(C)CC[C@@H]1[C@]3(C)CC=C(C1(C)C)c1ccc(cc1)C(=O)O)NCCN1CCS(=O)(=O)CC1 |
