methyl {[4-(4-chlorophenyl)pyrimidin-2-yl]sulfanyl}acetate
Chemical Structure Depiction of
methyl {[4-(4-chlorophenyl)pyrimidin-2-yl]sulfanyl}acetate
methyl {[4-(4-chlorophenyl)pyrimidin-2-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | Y502-7041 |
| Compound Name: | methyl {[4-(4-chlorophenyl)pyrimidin-2-yl]sulfanyl}acetate |
| Molecular Weight: | 294.76 |
| Molecular Formula: | C13 H11 Cl N2 O2 S |
| Smiles: | COC(CSc1nccc(c2ccc(cc2)[Cl])n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3885 |
| logD: | 3.3885 |
| logSw: | -3.8653 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 38.271 |
| InChI Key: | KOFGTVXPIJFBAA-UHFFFAOYSA-N |