2-[(2,5-dioxo-1-phenylpyrrolidin-3-yl)sulfanyl]-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2-[(2,5-dioxo-1-phenylpyrrolidin-3-yl)sulfanyl]-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile
2-[(2,5-dioxo-1-phenylpyrrolidin-3-yl)sulfanyl]-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | 3368-0046 |
| Compound Name: | 2-[(2,5-dioxo-1-phenylpyrrolidin-3-yl)sulfanyl]-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile |
| Molecular Weight: | 377.46 |
| Molecular Formula: | C21 H19 N3 O2 S |
| Smiles: | CC1CCc2c(C1)cc(C#N)c(n2)SC1CC(N(C1=O)c1ccccc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.4581 |
| logD: | 3.4581 |
| logSw: | -3.8064 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.382 |
| InChI Key: | AFKSUMBFJPLSIY-UHFFFAOYSA-N |