3-{[2-(3,4-dimethoxyphenyl)-2-oxoethyl]sulfanyl}-1-(2-methoxy-5-methylphenyl)pyrazin-2(1H)-one
Chemical Structure Depiction of
3-{[2-(3,4-dimethoxyphenyl)-2-oxoethyl]sulfanyl}-1-(2-methoxy-5-methylphenyl)pyrazin-2(1H)-one
3-{[2-(3,4-dimethoxyphenyl)-2-oxoethyl]sulfanyl}-1-(2-methoxy-5-methylphenyl)pyrazin-2(1H)-one
Compound characteristics
| Compound ID: | G195-0877 |
| Compound Name: | 3-{[2-(3,4-dimethoxyphenyl)-2-oxoethyl]sulfanyl}-1-(2-methoxy-5-methylphenyl)pyrazin-2(1H)-one |
| Molecular Weight: | 426.49 |
| Molecular Formula: | C22 H22 N2 O5 S |
| Smiles: | Cc1ccc(c(c1)N1C=CN=C(C1=O)SCC(c1ccc(c(c1)OC)OC)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.4453 |
| logD: | 2.4453 |
| logSw: | -2.6138 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 59.48 |
| InChI Key: | BSYDSGUOVNWWPR-UHFFFAOYSA-N |