methyl phenyl{2-[(pyrimidin-2-yl)sulfanyl]acetamido}acetate
Chemical Structure Depiction of
methyl phenyl{2-[(pyrimidin-2-yl)sulfanyl]acetamido}acetate
methyl phenyl{2-[(pyrimidin-2-yl)sulfanyl]acetamido}acetate
Compound characteristics
| Compound ID: | 8016-2583 |
| Compound Name: | methyl phenyl{2-[(pyrimidin-2-yl)sulfanyl]acetamido}acetate |
| Molecular Weight: | 317.36 |
| Molecular Formula: | C15 H15 N3 O3 S |
| Smiles: | COC(C(c1ccccc1)NC(CSc1ncccn1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.9999 |
| logD: | 0.9999 |
| logSw: | -2.2385 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.122 |
| InChI Key: | XDMHOFISFWXOPO-CYBMUJFWSA-N |