3-[4-(3-phenylprop-2-yn-1-yl)morpholin-4-ium-4-yl]propane-1-sulfonate
Chemical Structure Depiction of
3-[4-(3-phenylprop-2-yn-1-yl)morpholin-4-ium-4-yl]propane-1-sulfonate
3-[4-(3-phenylprop-2-yn-1-yl)morpholin-4-ium-4-yl]propane-1-sulfonate
Compound characteristics
| Compound ID: | 8008-9460 |
| Compound Name: | 3-[4-(3-phenylprop-2-yn-1-yl)morpholin-4-ium-4-yl]propane-1-sulfonate |
| Molecular Weight: | 323.41 |
| Molecular Formula: | C16 H21 N O4 S |
| Smiles: | C(C[N+]1(CCOCC1)CC#Cc1ccccc1)CS([O-])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.3405 |
| logD: | 0.3405 |
| logSw: | -1.8294 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.083 |
| InChI Key: | IPRUBWBLLFLOJQ-UHFFFAOYSA-N |