methyl 4-{[({[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetyl}oxy)acetyl]oxy}benzoate
Chemical Structure Depiction of
methyl 4-{[({[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetyl}oxy)acetyl]oxy}benzoate
methyl 4-{[({[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetyl}oxy)acetyl]oxy}benzoate
Compound characteristics
| Compound ID: | 8008-2390 |
| Compound Name: | methyl 4-{[({[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetyl}oxy)acetyl]oxy}benzoate |
| Molecular Weight: | 390.41 |
| Molecular Formula: | C18 H18 N2 O6 S |
| Smiles: | Cc1cc(C)nc(n1)SCC(=O)OCC(=O)Oc1ccc(cc1)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.5524 |
| logD: | 2.5524 |
| logSw: | -2.8643 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 78.635 |
| InChI Key: | BBXDAXCPIMPAEH-UHFFFAOYSA-N |