3-{[1-(3,4-dimethylphenyl)-1-oxopropan-2-yl]sulfanyl}-1-(2-methoxyphenyl)pyrazin-2(1H)-one
Chemical Structure Depiction of
3-{[1-(3,4-dimethylphenyl)-1-oxopropan-2-yl]sulfanyl}-1-(2-methoxyphenyl)pyrazin-2(1H)-one
3-{[1-(3,4-dimethylphenyl)-1-oxopropan-2-yl]sulfanyl}-1-(2-methoxyphenyl)pyrazin-2(1H)-one
Compound characteristics
| Compound ID: | G195-0797 |
| Compound Name: | 3-{[1-(3,4-dimethylphenyl)-1-oxopropan-2-yl]sulfanyl}-1-(2-methoxyphenyl)pyrazin-2(1H)-one |
| Molecular Weight: | 394.49 |
| Molecular Formula: | C22 H22 N2 O3 S |
| Smiles: | CC(C(c1ccc(C)c(C)c1)=O)SC1C(N(C=CN=1)c1ccccc1OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.878 |
| logD: | 3.878 |
| logSw: | -4.0714 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 44.711 |
| InChI Key: | STGYSLUWVYKJKW-INIZCTEOSA-N |