2-{[5-(benzenesulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2,4-dimethoxyphenyl)acetamide
Chemical Structure Depiction of
2-{[5-(benzenesulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2,4-dimethoxyphenyl)acetamide
2-{[5-(benzenesulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2,4-dimethoxyphenyl)acetamide
Compound characteristics
Compound ID: | C716-0014 |
Compound Name: | 2-{[5-(benzenesulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2,4-dimethoxyphenyl)acetamide |
Molecular Weight: | 461.51 |
Molecular Formula: | C20 H19 N3 O6 S2 |
Smiles: | COc1ccc(c(c1)OC)NC(CSC1NC(C(=CN=1)S(c1ccccc1)(=O)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 1.5787 |
logD: | -0.0631 |
logSw: | -2.6305 |
Hydrogen bond acceptors count: | 12 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 101.617 |
InChI Key: | JICXPJTYOBIHDI-UHFFFAOYSA-N |