2-{[5-(4-ethylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-{[5-(4-ethylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
2-{[5-(4-ethylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | C200-2454 |
| Compound Name: | 2-{[5-(4-ethylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide |
| Molecular Weight: | 459.54 |
| Molecular Formula: | C21 H21 N3 O5 S2 |
| Smiles: | CCc1ccc(cc1)S(C1=CN=C(NC1=O)SCC(Nc1ccc(cc1)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9315 |
| logD: | 1.2898 |
| logSw: | -3.6427 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.684 |
| InChI Key: | XIHFYUCOZZQHQI-UHFFFAOYSA-N |