2-{[1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl}-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2-{[1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl}-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile
2-{[1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl}-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | 3368-0666 |
| Compound Name: | 2-{[1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl}-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile |
| Molecular Weight: | 421.52 |
| Molecular Formula: | C23 H23 N3 O3 S |
| Smiles: | CCOc1ccc(cc1)N1C(CC(C1=O)Sc1c(C#N)cc2CC(C)CCc2n1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.9486 |
| logD: | 3.9486 |
| logSw: | -4.0139 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.506 |
| InChI Key: | RTKSHCVGXUSBJZ-UHFFFAOYSA-N |