1-[2-(benzylamino)-2-oxoethyl]-3-[(hydroxyimino)methyl]pyridin-1-ium--chloride (1/1)
Chemical Structure Depiction of
1-[2-(benzylamino)-2-oxoethyl]-3-[(hydroxyimino)methyl]pyridin-1-ium--chloride (1/1)
1-[2-(benzylamino)-2-oxoethyl]-3-[(hydroxyimino)methyl]pyridin-1-ium--chloride (1/1)
Compound characteristics
| Compound ID: | 0134-0079 |
| Compound Name: | 1-[2-(benzylamino)-2-oxoethyl]-3-[(hydroxyimino)methyl]pyridin-1-ium--chloride (1/1) |
| Molecular Weight: | 305.76 |
| Molecular Formula: | C15 H16 N3 O2 |
| Salt: | Cl- |
| Smiles: | C(c1ccccc1)NC(C[n+]1cccc(/C=N/O)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8086 |
| logD: | 1.8075 |
| logSw: | -1.9609 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.411 |
| InChI Key: | UXXKDVNCAOAZAR-LICLKQGHSA-O |