1-(2,4-difluorophenyl)-2-{[4-(1-ethyl-3-methyl-1H-pyrazol-4-yl)pyrimidin-2-yl]sulfanyl}ethan-1-one
Chemical Structure Depiction of
1-(2,4-difluorophenyl)-2-{[4-(1-ethyl-3-methyl-1H-pyrazol-4-yl)pyrimidin-2-yl]sulfanyl}ethan-1-one
1-(2,4-difluorophenyl)-2-{[4-(1-ethyl-3-methyl-1H-pyrazol-4-yl)pyrimidin-2-yl]sulfanyl}ethan-1-one
Compound characteristics
| Compound ID: | Y503-1566 |
| Compound Name: | 1-(2,4-difluorophenyl)-2-{[4-(1-ethyl-3-methyl-1H-pyrazol-4-yl)pyrimidin-2-yl]sulfanyl}ethan-1-one |
| Molecular Weight: | 374.41 |
| Molecular Formula: | C18 H16 F2 N4 O S |
| Smiles: | CCn1cc(c2ccnc(n2)SCC(c2ccc(cc2F)F)=O)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.3126 |
| logD: | 3.3126 |
| logSw: | -3.538 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.522 |
| InChI Key: | PPYJSNBJYVXKJB-UHFFFAOYSA-N |