1-[2-(4-bromophenyl)-2-oxoethyl]quinolin-1-ium--bromide (1/1)
Chemical Structure Depiction of
1-[2-(4-bromophenyl)-2-oxoethyl]quinolin-1-ium--bromide (1/1)
1-[2-(4-bromophenyl)-2-oxoethyl]quinolin-1-ium--bromide (1/1)
Compound characteristics
| Compound ID: | 0327-0050 |
| Compound Name: | 1-[2-(4-bromophenyl)-2-oxoethyl]quinolin-1-ium--bromide (1/1) |
| Molecular Weight: | 407.1 |
| Molecular Formula: | C17 H13 Br N O |
| Salt: | Br- |
| Smiles: | C(C(c1ccc(cc1)[Br])=O)[n+]1cccc2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 3.9439 |
| logD: | 3.9439 |
| logSw: | -3.9444 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 14.306 |
| InChI Key: | XZSHZAYQDYVLAL-UHFFFAOYSA-N |