methyl 4-({[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetyl}oxy)benzoate
Chemical Structure Depiction of
methyl 4-({[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetyl}oxy)benzoate
methyl 4-({[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetyl}oxy)benzoate
Compound characteristics
| Compound ID: | 8005-5928 |
| Compound Name: | methyl 4-({[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetyl}oxy)benzoate |
| Molecular Weight: | 332.38 |
| Molecular Formula: | C16 H16 N2 O4 S |
| Smiles: | Cc1cc(C)nc(n1)SCC(=O)Oc1ccc(cc1)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.9573 |
| logD: | 2.9573 |
| logSw: | -3.2972 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 58.101 |
| InChI Key: | LXVJWXXPQADARC-UHFFFAOYSA-N |