ethyl 4-(3-bromophenyl)-2,5-dioxo-7-(thiophen-2-yl)-1,2,3,4,5,6,7,8-octahydroquinoline-6-carboxylate
Chemical Structure Depiction of
ethyl 4-(3-bromophenyl)-2,5-dioxo-7-(thiophen-2-yl)-1,2,3,4,5,6,7,8-octahydroquinoline-6-carboxylate
ethyl 4-(3-bromophenyl)-2,5-dioxo-7-(thiophen-2-yl)-1,2,3,4,5,6,7,8-octahydroquinoline-6-carboxylate
Compound characteristics
| Compound ID: | 8017-0057 |
| Compound Name: | ethyl 4-(3-bromophenyl)-2,5-dioxo-7-(thiophen-2-yl)-1,2,3,4,5,6,7,8-octahydroquinoline-6-carboxylate |
| Molecular Weight: | 474.37 |
| Molecular Formula: | C22 H20 Br N O4 S |
| Smiles: | CCOC(C1C(CC2=C(C(CC(N2)=O)c2cccc(c2)[Br])C1=O)c1cccs1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.9415 |
| logD: | 3.0367 |
| logSw: | -3.9561 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.405 |
| InChI Key: | OVVLJPZVPOCQAJ-UHFFFAOYSA-N |