4-[3-(4-methylpiperidin-1-yl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}benzamide
Chemical Structure Depiction of
4-[3-(4-methylpiperidin-1-yl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}benzamide
4-[3-(4-methylpiperidin-1-yl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}benzamide
Compound characteristics
| Compound ID: | M712-0940 |
| Compound Name: | 4-[3-(4-methylpiperidin-1-yl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}benzamide |
| Molecular Weight: | 449.57 |
| Molecular Formula: | C25 H27 N3 O3 S |
| Smiles: | CC1CCN(CC1)C1=CC(N(C1=O)c1ccc(cc1)C(NCc1ccc(cc1)SC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3071 |
| logD: | 3.3051 |
| logSw: | -3.7108 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.022 |
| InChI Key: | GNVQULJUBPPVBJ-UHFFFAOYSA-N |