N-[(3-bromophenyl)methyl]-1-(4-fluorophenyl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Chemical Structure Depiction of
N-[(3-bromophenyl)methyl]-1-(4-fluorophenyl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
N-[(3-bromophenyl)methyl]-1-(4-fluorophenyl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Compound characteristics
| Compound ID: | L372-0241 |
| Compound Name: | N-[(3-bromophenyl)methyl]-1-(4-fluorophenyl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide |
| Molecular Weight: | 469.31 |
| Molecular Formula: | C23 H18 Br F N2 O3 |
| Smiles: | C1CC2=C(C=C(C(NCc3cccc(c3)[Br])=O)C(N2c2ccc(cc2)F)=O)C(C1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2398 |
| logD: | 3.2379 |
| logSw: | -3.5594 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.993 |
| InChI Key: | ROUXBEXHUMBWCJ-UHFFFAOYSA-N |