3-{[2-(3,4-dimethoxyphenyl)-2-oxoethyl]sulfanyl}-1-(4-methoxyphenyl)pyrazin-2(1H)-one
Chemical Structure Depiction of
3-{[2-(3,4-dimethoxyphenyl)-2-oxoethyl]sulfanyl}-1-(4-methoxyphenyl)pyrazin-2(1H)-one
3-{[2-(3,4-dimethoxyphenyl)-2-oxoethyl]sulfanyl}-1-(4-methoxyphenyl)pyrazin-2(1H)-one
Compound characteristics
| Compound ID: | G195-0835 |
| Compound Name: | 3-{[2-(3,4-dimethoxyphenyl)-2-oxoethyl]sulfanyl}-1-(4-methoxyphenyl)pyrazin-2(1H)-one |
| Molecular Weight: | 412.46 |
| Molecular Formula: | C21 H20 N2 O5 S |
| Smiles: | COc1ccc(cc1)N1C=CN=C(C1=O)SCC(c1ccc(c(c1)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0814 |
| logD: | 2.0814 |
| logSw: | -2.8212 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 59.694 |
| InChI Key: | AYIZPUURKAZGOM-UHFFFAOYSA-N |