2,5-dioxo-1-(2,4,6-trimethylphenyl)-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2,5-dioxo-1-(2,4,6-trimethylphenyl)-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile
2,5-dioxo-1-(2,4,6-trimethylphenyl)-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | F454-0035 |
| Compound Name: | 2,5-dioxo-1-(2,4,6-trimethylphenyl)-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile |
| Molecular Weight: | 306.36 |
| Molecular Formula: | C19 H18 N2 O2 |
| Smiles: | Cc1cc(C)c(c(C)c1)N1C2CCCC(C=2C=C(C#N)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5274 |
| logD: | 3.5274 |
| logSw: | -3.7276 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.034 |
| InChI Key: | FBBUZTABPIEPFC-UHFFFAOYSA-N |