methyl 2-{2-[(4-hydroxy-6-propylpyrimidin-2-yl)sulfanyl]acetamido}benzoate
Chemical Structure Depiction of
methyl 2-{2-[(4-hydroxy-6-propylpyrimidin-2-yl)sulfanyl]acetamido}benzoate
methyl 2-{2-[(4-hydroxy-6-propylpyrimidin-2-yl)sulfanyl]acetamido}benzoate
Compound characteristics
| Compound ID: | 8014-5653 |
| Compound Name: | methyl 2-{2-[(4-hydroxy-6-propylpyrimidin-2-yl)sulfanyl]acetamido}benzoate |
| Molecular Weight: | 361.42 |
| Molecular Formula: | C17 H19 N3 O4 S |
| Smiles: | CCCc1cc(nc(n1)SCC(Nc1ccccc1C(=O)OC)=O)O |
| Stereo: | ACHIRAL |
| logP: | 3.031 |
| logD: | 2.9418 |
| logSw: | -3.4127 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.64 |
| InChI Key: | LOSJPCKRKHAIGI-UHFFFAOYSA-N |