Base information
| Cat. No. | |
| CAS No. | 53213-82-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C29H37IN2O2 |
| Molecular Weight | 572.521 |
| Exact Mass | 572.19 |
| XLogP3 | 4.7035 |
| Mr | 157.36 |
| PSA | 29.49 |
| Sequence | - |
| Atom number | 71 |
| Bond number | 73 |
| Ring number | 4 |
| Rotor number | 12 |
| Residues number | 0 |
| Canonical smiles | CCCCCCN1C(=CC=Cc2oc3c([n+]2CCCCCC)cccc3)Oc2c1cccc2.[I-] |
