1-(2-carbamamido-2-oxoethyl)-3-carbamoylpyridin-1-ium--chloride (1/1)
Chemical Structure Depiction of
1-(2-carbamamido-2-oxoethyl)-3-carbamoylpyridin-1-ium--chloride (1/1)
1-(2-carbamamido-2-oxoethyl)-3-carbamoylpyridin-1-ium--chloride (1/1)
Compound characteristics
| Compound ID: | 0173-0025 |
| Compound Name: | 1-(2-carbamamido-2-oxoethyl)-3-carbamoylpyridin-1-ium--chloride (1/1) |
| Molecular Weight: | 258.66 |
| Molecular Formula: | C9 H11 N4 O3 |
| Salt: | Cl- |
| Smiles: | C(C(NC(N)=O)=O)[n+]1cccc(c1)C(N)=O |
| Stereo: | ACHIRAL |
| logP: | -1.3355 |
| logD: | -1.336 |
| logSw: | -1.5567 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 5 |
| Polar surface area: | 95.28 |
| InChI Key: | ACJYTVFQGQXDTM-UHFFFAOYSA-O |