1-(4-hydroxy-4,4-diphenylbut-2-yn-1-yl)-1-propylpiperidin-1-ium--bromide (1/1)
Chemical Structure Depiction of
1-(4-hydroxy-4,4-diphenylbut-2-yn-1-yl)-1-propylpiperidin-1-ium--bromide (1/1)
1-(4-hydroxy-4,4-diphenylbut-2-yn-1-yl)-1-propylpiperidin-1-ium--bromide (1/1)
Compound characteristics
| Compound ID: | 4782-0212 |
| Compound Name: | 1-(4-hydroxy-4,4-diphenylbut-2-yn-1-yl)-1-propylpiperidin-1-ium--bromide (1/1) |
| Molecular Weight: | 428.41 |
| Molecular Formula: | C24 H30 N O |
| Salt: | Br- |
| Smiles: | CCC[N+]1(CCCCC1)CC#CC(c1ccccc1)(c1ccccc1)O |
| Stereo: | ACHIRAL |
| logP: | 4.7221 |
| logD: | 4.7221 |
| logSw: | -4.3205 |
| Hydrogen bond acceptors count: | 1 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 16.3793 |
| InChI Key: | YTMYJBWWOOFKCK-UHFFFAOYSA-N |