1-(3,5-dimethylphenyl)-3-{[2-(4-ethoxyphenyl)-2-oxoethyl]sulfanyl}pyrazin-2(1H)-one
Chemical Structure Depiction of
1-(3,5-dimethylphenyl)-3-{[2-(4-ethoxyphenyl)-2-oxoethyl]sulfanyl}pyrazin-2(1H)-one
1-(3,5-dimethylphenyl)-3-{[2-(4-ethoxyphenyl)-2-oxoethyl]sulfanyl}pyrazin-2(1H)-one
Compound characteristics
| Compound ID: | G195-0752 |
| Compound Name: | 1-(3,5-dimethylphenyl)-3-{[2-(4-ethoxyphenyl)-2-oxoethyl]sulfanyl}pyrazin-2(1H)-one |
| Molecular Weight: | 394.49 |
| Molecular Formula: | C22 H22 N2 O3 S |
| Smiles: | CCOc1ccc(cc1)C(CSC1C(N(C=CN=1)c1cc(C)cc(C)c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6833 |
| logD: | 3.6833 |
| logSw: | -3.9254 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 44.013 |
| InChI Key: | XLCCASMMQJWTJG-UHFFFAOYSA-N |