N-(2-ethoxyphenyl)-2-{[5-(4-methylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2-ethoxyphenyl)-2-{[5-(4-methylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide
N-(2-ethoxyphenyl)-2-{[5-(4-methylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | C716-0087 |
| Compound Name: | N-(2-ethoxyphenyl)-2-{[5-(4-methylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 459.54 |
| Molecular Formula: | C21 H21 N3 O5 S2 |
| Smiles: | CCOc1ccccc1NC(CSC1NC(C(=CN=1)S(c1ccc(C)cc1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6165 |
| logD: | 0.9748 |
| logSw: | -3.1141 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.653 |
| InChI Key: | LNTZRVAGFYTXER-UHFFFAOYSA-N |