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 |