N-(3-acetylphenyl)-2-[(2,6-dimethylpyrimidin-4-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-2-[(2,6-dimethylpyrimidin-4-yl)sulfanyl]acetamide
N-(3-acetylphenyl)-2-[(2,6-dimethylpyrimidin-4-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D306-0058 |
| Compound Name: | N-(3-acetylphenyl)-2-[(2,6-dimethylpyrimidin-4-yl)sulfanyl]acetamide |
| Molecular Weight: | 315.39 |
| Molecular Formula: | C16 H17 N3 O2 S |
| Smiles: | CC(c1cccc(c1)NC(CSc1cc(C)nc(C)n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2078 |
| logD: | 2.2067 |
| logSw: | -2.8292 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.294 |
| InChI Key: | XIIQWLPFELMKSC-UHFFFAOYSA-N |