3-benzamido-1-[2-(4-benzamidophenyl)-2-oxoethyl]pyridin-1-ium--bromide (1/1)
Chemical Structure Depiction of
3-benzamido-1-[2-(4-benzamidophenyl)-2-oxoethyl]pyridin-1-ium--bromide (1/1)
3-benzamido-1-[2-(4-benzamidophenyl)-2-oxoethyl]pyridin-1-ium--bromide (1/1)
Compound characteristics
| Compound ID: | 0557-0495 |
| Compound Name: | 3-benzamido-1-[2-(4-benzamidophenyl)-2-oxoethyl]pyridin-1-ium--bromide (1/1) |
| Molecular Weight: | 516.39 |
| Molecular Formula: | C27 H22 N3 O3 |
| Salt: | Br- |
| Smiles: | C(C(c1ccc(cc1)NC(c1ccccc1)=O)=O)[n+]1cccc(c1)NC(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.682 |
| logD: | 3.6737 |
| logSw: | -3.9918 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.353 |
| InChI Key: | VARJULNXGISUBP-UHFFFAOYSA-O |