N-(2-bromophenyl)-2-{[5-(4-ethylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2-bromophenyl)-2-{[5-(4-ethylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide
N-(2-bromophenyl)-2-{[5-(4-ethylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide
Compound characteristics
Compound ID: | G605-0973 |
Compound Name: | N-(2-bromophenyl)-2-{[5-(4-ethylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide |
Molecular Weight: | 508.41 |
Molecular Formula: | C20 H18 Br N3 O4 S2 |
Smiles: | CCc1ccc(cc1)S(C1=CN=C(NC1=O)SCC(Nc1ccccc1[Br])=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.2119 |
logD: | 1.5702 |
logSw: | -3.5638 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 86.442 |
InChI Key: | QGAIFIRHOHROST-UHFFFAOYSA-N |