1-benzyl-3-carbamoylpyridin-1-ium--chloride (1/1)
Chemical Structure Depiction of
1-benzyl-3-carbamoylpyridin-1-ium--chloride (1/1)
1-benzyl-3-carbamoylpyridin-1-ium--chloride (1/1)
Compound characteristics
| Compound ID: | 0688-0752 |
| Compound Name: | 1-benzyl-3-carbamoylpyridin-1-ium--chloride (1/1) |
| Molecular Weight: | 248.71 |
| Molecular Formula: | C13 H13 N2 O |
| Salt: | Cl- |
| Smiles: | C(c1ccccc1)[n+]1cccc(c1)C(N)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4463 |
| logD: | 1.4463 |
| logSw: | -1.5079 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 36.983 |
| InChI Key: | GPBSRPLIMMWMQS-UHFFFAOYSA-O |