1-(4-methylphenyl)-2,5-dioxo-7-phenyl-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
1-(4-methylphenyl)-2,5-dioxo-7-phenyl-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile
1-(4-methylphenyl)-2,5-dioxo-7-phenyl-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | F454-0150 |
| Compound Name: | 1-(4-methylphenyl)-2,5-dioxo-7-phenyl-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile |
| Molecular Weight: | 354.41 |
| Molecular Formula: | C23 H18 N2 O2 |
| Smiles: | Cc1ccc(cc1)N1C2CC(CC(C=2C=C(C#N)C1=O)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8018 |
| logD: | 3.8018 |
| logSw: | -3.9853 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.364 |
| InChI Key: | RRNKPRGJMLRCRS-KRWDZBQOSA-N |