Base information
| Cat. No. | |
| CAS No. | 180144-69-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C27H29ClN2O5 |
| Molecular Weight | 496.983 |
| Exact Mass | 496.176 |
| XLogP3 | 2.0396 |
| Mr | 139.032 |
| PSA | 118.89 |
| Sequence | - |
| Atom number | 64 |
| Bond number | 66 |
| Ring number | 4 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | CCNC1=CC2[OH+]c3cc(NCC)c(cc3C(=C2C=C1C)c1ccc(cc1C(=O)O)C(=O)O)C.[Cl-] |
