3-{[2-(2,5-dimethoxyphenyl)-2-oxoethyl]sulfanyl}-1-(4-fluorophenyl)pyrazin-2(1H)-one
Chemical Structure Depiction of
3-{[2-(2,5-dimethoxyphenyl)-2-oxoethyl]sulfanyl}-1-(4-fluorophenyl)pyrazin-2(1H)-one
3-{[2-(2,5-dimethoxyphenyl)-2-oxoethyl]sulfanyl}-1-(4-fluorophenyl)pyrazin-2(1H)-one
Compound characteristics
| Compound ID: | G195-0258 |
| Compound Name: | 3-{[2-(2,5-dimethoxyphenyl)-2-oxoethyl]sulfanyl}-1-(4-fluorophenyl)pyrazin-2(1H)-one |
| Molecular Weight: | 400.43 |
| Molecular Formula: | C20 H17 F N2 O4 S |
| Smiles: | COc1ccc(c(c1)C(CSC1C(N(C=CN=1)c1ccc(cc1)F)=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.3811 |
| logD: | 2.3811 |
| logSw: | -2.9166 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 52.064 |
| InChI Key: | YRLLQLGFYXPMQU-UHFFFAOYSA-N |