4-{[2,3-dioxo-4-(propan-2-yl)piperazin-1-yl]methyl}-N-[2-(methylsulfanyl)phenyl]benzamide
Chemical Structure Depiction of
4-{[2,3-dioxo-4-(propan-2-yl)piperazin-1-yl]methyl}-N-[2-(methylsulfanyl)phenyl]benzamide
4-{[2,3-dioxo-4-(propan-2-yl)piperazin-1-yl]methyl}-N-[2-(methylsulfanyl)phenyl]benzamide
Compound characteristics
| Compound ID: | M116-0646 |
| Compound Name: | 4-{[2,3-dioxo-4-(propan-2-yl)piperazin-1-yl]methyl}-N-[2-(methylsulfanyl)phenyl]benzamide |
| Molecular Weight: | 411.52 |
| Molecular Formula: | C22 H25 N3 O3 S |
| Smiles: | CC(C)N1CCN(Cc2ccc(cc2)C(Nc2ccccc2SC)=O)C(C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.641 |
| logD: | 2.6408 |
| logSw: | -3.1295 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.835 |
| InChI Key: | LUCZOQIRHNTSCD-UHFFFAOYSA-N |