1-{2-[di(propan-2-yl)amino]-2-oxoethyl}-4-[(hydroxyimino)methyl]pyridin-1-ium--chloride (1/1)
Chemical Structure Depiction of
1-{2-[di(propan-2-yl)amino]-2-oxoethyl}-4-[(hydroxyimino)methyl]pyridin-1-ium--chloride (1/1)
1-{2-[di(propan-2-yl)amino]-2-oxoethyl}-4-[(hydroxyimino)methyl]pyridin-1-ium--chloride (1/1)
Compound characteristics
| Compound ID: | 0134-0074 |
| Compound Name: | 1-{2-[di(propan-2-yl)amino]-2-oxoethyl}-4-[(hydroxyimino)methyl]pyridin-1-ium--chloride (1/1) |
| Molecular Weight: | 299.8 |
| Molecular Formula: | C14 H22 N3 O2 |
| Salt: | Cl- |
| Smiles: | CC(C)N(C(C)C)C(C[n+]1ccc(/C=N/O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6046 |
| logD: | 1.6042 |
| logSw: | -1.9189 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.868 |
| InChI Key: | VQOIIKQYUBJBAH-UHFFFAOYSA-O |