1,3-phenylene bis{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetate}
Chemical Structure Depiction of
1,3-phenylene bis{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetate}
1,3-phenylene bis{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetate}
Compound characteristics
| Compound ID: | 8006-9658 |
| Compound Name: | 1,3-phenylene bis{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetate} |
| Molecular Weight: | 470.57 |
| Molecular Formula: | C22 H22 N4 O4 S2 |
| Smiles: | Cc1cc(C)nc(n1)SCC(=O)Oc1cccc(c1)OC(CSc1nc(C)cc(C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4374 |
| logD: | 3.4374 |
| logSw: | -3.7316 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 73.616 |
| InChI Key: | LADIFVLKBXRFFD-UHFFFAOYSA-N |