8-ethyl-4,4-dimethyl-6-({4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methyl)-4H-pyrrolo[3,2,1-ij]quinoline-1,2-dione
Chemical Structure Depiction of
8-ethyl-4,4-dimethyl-6-({4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methyl)-4H-pyrrolo[3,2,1-ij]quinoline-1,2-dione
8-ethyl-4,4-dimethyl-6-({4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methyl)-4H-pyrrolo[3,2,1-ij]quinoline-1,2-dione
Compound characteristics
| Compound ID: | Y021-0943 |
| Compound Name: | 8-ethyl-4,4-dimethyl-6-({4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methyl)-4H-pyrrolo[3,2,1-ij]quinoline-1,2-dione |
| Molecular Weight: | 483.53 |
| Molecular Formula: | C27 H28 F3 N3 O2 |
| Smiles: | CCc1cc2C(CN3CCN(CC3)c3cccc(c3)C(F)(F)F)=CC(C)(C)N3C(C(c(c1)c23)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1504 |
| logD: | 4.794 |
| logSw: | -5.0893 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.832 |
| InChI Key: | DKJGXEIXZPVJFV-UHFFFAOYSA-N |