4-carbamoyl-1-{2-[di(prop-2-en-1-yl)amino]-2-oxoethyl}pyridin-1-ium--chloride (1/1)
Chemical Structure Depiction of
4-carbamoyl-1-{2-[di(prop-2-en-1-yl)amino]-2-oxoethyl}pyridin-1-ium--chloride (1/1)
4-carbamoyl-1-{2-[di(prop-2-en-1-yl)amino]-2-oxoethyl}pyridin-1-ium--chloride (1/1)
Compound characteristics
| Compound ID: | 0173-0010 |
| Compound Name: | 4-carbamoyl-1-{2-[di(prop-2-en-1-yl)amino]-2-oxoethyl}pyridin-1-ium--chloride (1/1) |
| Molecular Weight: | 295.77 |
| Molecular Formula: | C14 H18 N3 O2 |
| Salt: | Cl- |
| Smiles: | C=CCN(CC=C)C(C[n+]1ccc(cc1)C(N)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.2981 |
| logD: | 0.2981 |
| logSw: | -1.1665 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.273 |
| InChI Key: | CXKVBMKLCIBTEU-UHFFFAOYSA-O |