4-(2-methoxyphenyl)-6-oxo-2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-1,4,5,6-tetrahydropyridine-3-carbonitrile
Chemical Structure Depiction of
4-(2-methoxyphenyl)-6-oxo-2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-1,4,5,6-tetrahydropyridine-3-carbonitrile
4-(2-methoxyphenyl)-6-oxo-2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-1,4,5,6-tetrahydropyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 4554-6476 |
| Compound Name: | 4-(2-methoxyphenyl)-6-oxo-2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-1,4,5,6-tetrahydropyridine-3-carbonitrile |
| Molecular Weight: | 371.46 |
| Molecular Formula: | C19 H21 N3 O3 S |
| Smiles: | COc1ccccc1C1CC(NC(=C1C#N)SCC(N1CCCC1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.151 |
| logD: | 2.0955 |
| logSw: | -2.7025 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.304 |
| InChI Key: | MNWVVMSVOBKPIY-CQSZACIVSA-N |