ethyl 1-(2,4-difluorophenyl)-4-(3-nitrophenyl)-2,5-dioxo-7-(thiophen-2-yl)-1,2,3,4,5,6,7,8-octahydroquinoline-6-carboxylate
Chemical Structure Depiction of
ethyl 1-(2,4-difluorophenyl)-4-(3-nitrophenyl)-2,5-dioxo-7-(thiophen-2-yl)-1,2,3,4,5,6,7,8-octahydroquinoline-6-carboxylate
ethyl 1-(2,4-difluorophenyl)-4-(3-nitrophenyl)-2,5-dioxo-7-(thiophen-2-yl)-1,2,3,4,5,6,7,8-octahydroquinoline-6-carboxylate
Compound characteristics
| Compound ID: | 8017-1494 |
| Compound Name: | ethyl 1-(2,4-difluorophenyl)-4-(3-nitrophenyl)-2,5-dioxo-7-(thiophen-2-yl)-1,2,3,4,5,6,7,8-octahydroquinoline-6-carboxylate |
| Molecular Weight: | 552.55 |
| Molecular Formula: | C28 H22 F2 N2 O6 S |
| Smiles: | CCOC(C1C(CC2=C(C(CC(N2c2ccc(cc2F)F)=O)c2cccc(c2)[N+]([O-])=O)C1=O)c1cccs1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.3876 |
| logD: | 4.3875 |
| logSw: | -4.3875 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 83.066 |
| InChI Key: | PSWBFDRDTQPVAK-UHFFFAOYSA-N |