1-[4,6-bis(methylsulfanyl)-2-phenylpyrimidin-5-yl]ethan-1-one
Chemical Structure Depiction of
1-[4,6-bis(methylsulfanyl)-2-phenylpyrimidin-5-yl]ethan-1-one
1-[4,6-bis(methylsulfanyl)-2-phenylpyrimidin-5-yl]ethan-1-one
Compound characteristics
| Compound ID: | 8006-2590 |
| Compound Name: | 1-[4,6-bis(methylsulfanyl)-2-phenylpyrimidin-5-yl]ethan-1-one |
| Molecular Weight: | 290.4 |
| Molecular Formula: | C14 H14 N2 O S2 |
| Smiles: | CC(c1c(nc(c2ccccc2)nc1SC)SC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4122 |
| logD: | 4.4122 |
| logSw: | -4.5186 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 32.628 |
| InChI Key: | RVRWQSVEBWTKEU-UHFFFAOYSA-N |