2-{[5-(2,4-dimethylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(3,4,5-trimethoxyphenyl)acetamide
Chemical Structure Depiction of
2-{[5-(2,4-dimethylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(3,4,5-trimethoxyphenyl)acetamide
2-{[5-(2,4-dimethylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(3,4,5-trimethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | C716-0832 |
| Compound Name: | 2-{[5-(2,4-dimethylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(3,4,5-trimethoxyphenyl)acetamide |
| Molecular Weight: | 519.59 |
| Molecular Formula: | C23 H25 N3 O7 S2 |
| Smiles: | Cc1ccc(c(C)c1)S(C1=CN=C(NC1=O)SCC(Nc1cc(c(c(c1)OC)OC)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2391 |
| logD: | 0.5974 |
| logSw: | -2.8669 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 110.118 |
| InChI Key: | XXIRLLIKXLKPEQ-UHFFFAOYSA-N |