2-{[5-(2,5-dimethylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-{[5-(2,5-dimethylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
2-{[5-(2,5-dimethylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
Compound characteristics
Compound ID: | C716-0265 |
Compound Name: | 2-{[5-(2,5-dimethylbenzene-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: | Cc1ccc(C)c(c1)S(C1=CN=C(NC1=O)SCC(Nc1ccc(cc1)OC)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 2.7253 |
logD: | 1.0835 |
logSw: | -3.217 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 94.684 |
InChI Key: | KYKQMZKOEDZRRO-UHFFFAOYSA-N |