4-(benzylcarbamoyl)-1-(2-oxo-2-phenylethyl)pyridin-1-ium--bromide (1/1)
Chemical Structure Depiction of
4-(benzylcarbamoyl)-1-(2-oxo-2-phenylethyl)pyridin-1-ium--bromide (1/1)
4-(benzylcarbamoyl)-1-(2-oxo-2-phenylethyl)pyridin-1-ium--bromide (1/1)
Compound characteristics
| Compound ID: | C200-9245 |
| Compound Name: | 4-(benzylcarbamoyl)-1-(2-oxo-2-phenylethyl)pyridin-1-ium--bromide (1/1) |
| Molecular Weight: | 411.3 |
| Molecular Formula: | C21 H19 N2 O2 |
| Salt: | Br- |
| Smiles: | C(c1ccccc1)NC(c1cc[n+](CC(c2ccccc2)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6635 |
| logD: | 2.6635 |
| logSw: | -2.8843 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.691 |
| InChI Key: | HZMMWLGBEXMQSV-UHFFFAOYSA-O |