3-{[2-(2,5-dimethylphenyl)-2-oxoethyl]sulfanyl}-1-(3-methylphenyl)pyrazin-2(1H)-one
Chemical Structure Depiction of
3-{[2-(2,5-dimethylphenyl)-2-oxoethyl]sulfanyl}-1-(3-methylphenyl)pyrazin-2(1H)-one
3-{[2-(2,5-dimethylphenyl)-2-oxoethyl]sulfanyl}-1-(3-methylphenyl)pyrazin-2(1H)-one
Compound characteristics
| Compound ID: | G195-0775 |
| Compound Name: | 3-{[2-(2,5-dimethylphenyl)-2-oxoethyl]sulfanyl}-1-(3-methylphenyl)pyrazin-2(1H)-one |
| Molecular Weight: | 364.46 |
| Molecular Formula: | C21 H20 N2 O2 S |
| Smiles: | Cc1cccc(c1)N1C=CN=C(C1=O)SCC(c1cc(C)ccc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7453 |
| logD: | 3.7453 |
| logSw: | -3.8277 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 36.89 |
| InChI Key: | KJJWYLCNNDRHLI-UHFFFAOYSA-N |