2-{[5-(benzenesulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
Chemical Structure Depiction of
2-{[5-(benzenesulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
2-{[5-(benzenesulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
Compound characteristics
| Compound ID: | C716-0023 |
| Compound Name: | 2-{[5-(benzenesulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide |
| Molecular Weight: | 459.5 |
| Molecular Formula: | C20 H17 N3 O6 S2 |
| Smiles: | C1COc2cc(ccc2O1)NC(CSC1NC(C(=CN=1)S(c1ccccc1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.806 |
| logD: | -0.8357 |
| logSw: | -2.4934 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 102.963 |
| InChI Key: | AWXQFRCKFNTLBJ-UHFFFAOYSA-N |