4-(2-oxo-2-phenylethyl)-4-(3-phenylprop-2-yn-1-yl)morpholin-4-ium--bromide (1/1)
Chemical Structure Depiction of
4-(2-oxo-2-phenylethyl)-4-(3-phenylprop-2-yn-1-yl)morpholin-4-ium--bromide (1/1)
4-(2-oxo-2-phenylethyl)-4-(3-phenylprop-2-yn-1-yl)morpholin-4-ium--bromide (1/1)
Compound characteristics
| Compound ID: | 5504-0107 |
| Compound Name: | 4-(2-oxo-2-phenylethyl)-4-(3-phenylprop-2-yn-1-yl)morpholin-4-ium--bromide (1/1) |
| Molecular Weight: | 400.31 |
| Molecular Formula: | C21 H22 N O2 |
| Salt: | Br- |
| Smiles: | C1COCC[N+]1(CC#Cc1ccccc1)CC(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2384 |
| logD: | 3.2384 |
| logSw: | -3.2745 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 22.0208 |
| InChI Key: | HMPRMGSAFZGPQY-UHFFFAOYSA-N |