2-amino-4-(2,5-dimethylphenyl)-7,7-dimethyl-5-oxo-1-(pyridin-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-(2,5-dimethylphenyl)-7,7-dimethyl-5-oxo-1-(pyridin-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
2-amino-4-(2,5-dimethylphenyl)-7,7-dimethyl-5-oxo-1-(pyridin-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | 8020-4568 |
| Compound Name: | 2-amino-4-(2,5-dimethylphenyl)-7,7-dimethyl-5-oxo-1-(pyridin-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile |
| Molecular Weight: | 398.51 |
| Molecular Formula: | C25 H26 N4 O |
| Smiles: | Cc1ccc(C)c(c1)C1C(C#N)=C(N)N(C2CC(C)(C)CC(C1=2)=O)c1cccnc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8068 |
| logD: | 3.8068 |
| logSw: | -3.7652 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.895 |
| InChI Key: | WQTHYXNVNGVADR-JOCHJYFZSA-N |