1-[2-(4-benzamidophenyl)-2-oxoethyl]-3-methylpyridin-1-ium--bromide (1/1)
Chemical Structure Depiction of
1-[2-(4-benzamidophenyl)-2-oxoethyl]-3-methylpyridin-1-ium--bromide (1/1)
1-[2-(4-benzamidophenyl)-2-oxoethyl]-3-methylpyridin-1-ium--bromide (1/1)
Compound characteristics
| Compound ID: | 0557-0483 |
| Compound Name: | 1-[2-(4-benzamidophenyl)-2-oxoethyl]-3-methylpyridin-1-ium--bromide (1/1) |
| Molecular Weight: | 411.3 |
| Molecular Formula: | C21 H19 N2 O2 |
| Salt: | Br- |
| Smiles: | Cc1ccc[n+](CC(c2ccc(cc2)NC(c2ccccc2)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.2835 |
| logD: | 3.2752 |
| logSw: | -3.3499 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.262 |
| InChI Key: | VEDCXAQYSKXFAP-UHFFFAOYSA-O |