1-(2-anilino-2-oxoethyl)pyridin-1-ium--bromide (1/1)
Chemical Structure Depiction of
1-(2-anilino-2-oxoethyl)pyridin-1-ium--bromide (1/1)
1-(2-anilino-2-oxoethyl)pyridin-1-ium--bromide (1/1)
Compound characteristics
| Compound ID: | 0986-0013 |
| Compound Name: | 1-(2-anilino-2-oxoethyl)pyridin-1-ium--bromide (1/1) |
| Molecular Weight: | 293.16 |
| Molecular Formula: | C13 H13 N2 O |
| Salt: | Br- |
| Smiles: | C(C(Nc1ccccc1)=O)[n+]1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 1.7586 |
| logD: | 1.7586 |
| logSw: | -2.1506 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 26.1804 |
| InChI Key: | DKIZHDDUTMSZEI-UHFFFAOYSA-O |