2,5'-dioxo-2'-(1H-pyrrol-1-yl)-1'-[3-(trifluoromethyl)phenyl]-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile
Chemical Structure Depiction of
2,5'-dioxo-2'-(1H-pyrrol-1-yl)-1'-[3-(trifluoromethyl)phenyl]-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile
2,5'-dioxo-2'-(1H-pyrrol-1-yl)-1'-[3-(trifluoromethyl)phenyl]-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile
Compound characteristics
| Compound ID: | 8017-9114 |
| Compound Name: | 2,5'-dioxo-2'-(1H-pyrrol-1-yl)-1'-[3-(trifluoromethyl)phenyl]-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile |
| Molecular Weight: | 500.48 |
| Molecular Formula: | C28 H19 F3 N4 O2 |
| Smiles: | C1CC2=C(C(C1)=O)C1(C(C#N)=C(N2c2cccc(c2)C(F)(F)F)n2cccc2)C(Nc2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9327 |
| logD: | 4.9327 |
| logSw: | -4.7964 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.797 |
| InChI Key: | SCUVPNHDNJCUGS-HHHXNRCGSA-N |