1-(4-chlorophenyl)-7,7-dimethyl-3-{4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl}-7,8-dihydroquinoline-2,5(1H,6H)-dione
Chemical Structure Depiction of
1-(4-chlorophenyl)-7,7-dimethyl-3-{4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl}-7,8-dihydroquinoline-2,5(1H,6H)-dione
1-(4-chlorophenyl)-7,7-dimethyl-3-{4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl}-7,8-dihydroquinoline-2,5(1H,6H)-dione
Compound characteristics
| Compound ID: | 4781-0155 |
| Compound Name: | 1-(4-chlorophenyl)-7,7-dimethyl-3-{4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl}-7,8-dihydroquinoline-2,5(1H,6H)-dione |
| Molecular Weight: | 558 |
| Molecular Formula: | C29 H27 Cl F3 N3 O3 |
| Smiles: | CC1(C)CC2=C(C=C(C(N3CCN(CC3)c3cccc(c3)C(F)(F)F)=O)C(N2c2ccc(cc2)[Cl])=O)C(C1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7546 |
| logD: | 4.7546 |
| logSw: | -4.9466 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.488 |
| InChI Key: | BLASKQDNPGBKCY-UHFFFAOYSA-N |