N-[4-(azepane-1-sulfonyl)phenyl]-2-[(2,6-dimethylpyrimidin-4-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[4-(azepane-1-sulfonyl)phenyl]-2-[(2,6-dimethylpyrimidin-4-yl)sulfanyl]acetamide
N-[4-(azepane-1-sulfonyl)phenyl]-2-[(2,6-dimethylpyrimidin-4-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D306-0553 |
| Compound Name: | N-[4-(azepane-1-sulfonyl)phenyl]-2-[(2,6-dimethylpyrimidin-4-yl)sulfanyl]acetamide |
| Molecular Weight: | 434.58 |
| Molecular Formula: | C20 H26 N4 O3 S2 |
| Smiles: | Cc1cc(nc(C)n1)SCC(Nc1ccc(cc1)S(N1CCCCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0601 |
| logD: | 3.0586 |
| logSw: | -3.4287 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.51 |
| InChI Key: | SZFXLAAGXNQIAX-UHFFFAOYSA-N |