N-(3,4-dimethoxyphenyl)-2-{[5-(4-fluoro-3-methylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(3,4-dimethoxyphenyl)-2-{[5-(4-fluoro-3-methylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide
N-(3,4-dimethoxyphenyl)-2-{[5-(4-fluoro-3-methylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | C716-0440 |
| Compound Name: | N-(3,4-dimethoxyphenyl)-2-{[5-(4-fluoro-3-methylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 493.53 |
| Molecular Formula: | C21 H20 F N3 O6 S2 |
| Smiles: | Cc1cc(ccc1F)S(C1=CN=C(NC1=O)SCC(Nc1ccc(c(c1)OC)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.913 |
| logD: | 0.2712 |
| logSw: | -2.8401 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 102.401 |
| InChI Key: | WAKGSCDVPWMNTP-UHFFFAOYSA-N |