3-{[2-(2,5-dimethylphenyl)-2-oxoethyl]sulfanyl}-1-(naphthalen-1-yl)pyrazin-2(1H)-one
Chemical Structure Depiction of
3-{[2-(2,5-dimethylphenyl)-2-oxoethyl]sulfanyl}-1-(naphthalen-1-yl)pyrazin-2(1H)-one
3-{[2-(2,5-dimethylphenyl)-2-oxoethyl]sulfanyl}-1-(naphthalen-1-yl)pyrazin-2(1H)-one
Compound characteristics
| Compound ID: | G195-0847 |
| Compound Name: | 3-{[2-(2,5-dimethylphenyl)-2-oxoethyl]sulfanyl}-1-(naphthalen-1-yl)pyrazin-2(1H)-one |
| Molecular Weight: | 400.5 |
| Molecular Formula: | C24 H20 N2 O2 S |
| Smiles: | Cc1ccc(C)c(c1)C(CSC1C(N(C=CN=1)c1cccc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4979 |
| logD: | 4.4979 |
| logSw: | -4.4444 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 36.317 |
| InChI Key: | PXXYSYOEIDCUMQ-UHFFFAOYSA-N |