dimethyl 2-{2-[(pyrimidin-2-yl)sulfanyl]acetamido}benzene-1,4-dicarboxylate
Chemical Structure Depiction of
dimethyl 2-{2-[(pyrimidin-2-yl)sulfanyl]acetamido}benzene-1,4-dicarboxylate
dimethyl 2-{2-[(pyrimidin-2-yl)sulfanyl]acetamido}benzene-1,4-dicarboxylate
Compound characteristics
| Compound ID: | Y205-6341 |
| Compound Name: | dimethyl 2-{2-[(pyrimidin-2-yl)sulfanyl]acetamido}benzene-1,4-dicarboxylate |
| Molecular Weight: | 361.37 |
| Molecular Formula: | C16 H15 N3 O5 S |
| Smiles: | COC(c1ccc(C(=O)OC)c(c1)NC(CSc1ncccn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6533 |
| logD: | 1.6066 |
| logSw: | -2.662 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.924 |
| InChI Key: | XNEYISCCJJJKEG-UHFFFAOYSA-N |