N-(4-ethylphenyl)-2-{[5-(4-fluoro-3-methylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(4-ethylphenyl)-2-{[5-(4-fluoro-3-methylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide
N-(4-ethylphenyl)-2-{[5-(4-fluoro-3-methylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | C716-0445 |
| Compound Name: | N-(4-ethylphenyl)-2-{[5-(4-fluoro-3-methylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 461.53 |
| Molecular Formula: | C21 H20 F N3 O4 S2 |
| Smiles: | CCc1ccc(cc1)NC(CSC1NC(C(=CN=1)S(c1ccc(c(C)c1)F)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3087 |
| logD: | 1.667 |
| logSw: | -3.6512 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.14 |
| InChI Key: | IWSARSLDXYBDSN-UHFFFAOYSA-N |