3-benzamido-1-(2-oxo-2-phenylethyl)pyridin-1-ium--bromide (1/1)
Chemical Structure Depiction of
3-benzamido-1-(2-oxo-2-phenylethyl)pyridin-1-ium--bromide (1/1)
3-benzamido-1-(2-oxo-2-phenylethyl)pyridin-1-ium--bromide (1/1)
Compound characteristics
| Compound ID: | 0327-0008 |
| Compound Name: | 3-benzamido-1-(2-oxo-2-phenylethyl)pyridin-1-ium--bromide (1/1) |
| Molecular Weight: | 397.27 |
| Molecular Formula: | C20 H17 N2 O2 |
| Salt: | Br- |
| Smiles: | C(C(c1ccccc1)=O)[n+]1cccc(c1)NC(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8509 |
| logD: | 2.8509 |
| logSw: | -3.3272 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.262 |
| InChI Key: | JWVVQOVWAOELGF-UHFFFAOYSA-O |