2,5-dioxo-1-phenyl-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2,5-dioxo-1-phenyl-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile
2,5-dioxo-1-phenyl-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | F454-0011 |
| Compound Name: | 2,5-dioxo-1-phenyl-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile |
| Molecular Weight: | 264.28 |
| Molecular Formula: | C16 H12 N2 O2 |
| Smiles: | C1CC2=C(C=C(C#N)C(N2c2ccccc2)=O)C(C1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5204 |
| logD: | 1.5204 |
| logSw: | -1.8775 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.636 |
| InChI Key: | YVOWZIREDFCHAH-UHFFFAOYSA-N |