1-(2,5-dimethoxyphenyl)-7,7-dimethyl-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
1-(2,5-dimethoxyphenyl)-7,7-dimethyl-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile
1-(2,5-dimethoxyphenyl)-7,7-dimethyl-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | C202-3409 |
| Compound Name: | 1-(2,5-dimethoxyphenyl)-7,7-dimethyl-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile |
| Molecular Weight: | 352.39 |
| Molecular Formula: | C20 H20 N2 O4 |
| Smiles: | CC1(C)CC2=C(C=C(C#N)C(N2c2cc(ccc2OC)OC)=O)C(C1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4595 |
| logD: | 2.4595 |
| logSw: | -2.616 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 60.509 |
| InChI Key: | HYNQLFSSBNCYIP-UHFFFAOYSA-N |