3-{[2-(2,5-dimethylphenyl)-2-oxoethyl]sulfanyl}-1-(3-fluorophenyl)pyrazin-2(1H)-one
Chemical Structure Depiction of
3-{[2-(2,5-dimethylphenyl)-2-oxoethyl]sulfanyl}-1-(3-fluorophenyl)pyrazin-2(1H)-one
3-{[2-(2,5-dimethylphenyl)-2-oxoethyl]sulfanyl}-1-(3-fluorophenyl)pyrazin-2(1H)-one
Compound characteristics
| Compound ID: | G195-0706 |
| Compound Name: | 3-{[2-(2,5-dimethylphenyl)-2-oxoethyl]sulfanyl}-1-(3-fluorophenyl)pyrazin-2(1H)-one |
| Molecular Weight: | 368.43 |
| Molecular Formula: | C20 H17 F N2 O2 S |
| Smiles: | Cc1ccc(C)c(c1)C(CSC1C(N(C=CN=1)c1cccc(c1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3224 |
| logD: | 3.3224 |
| logSw: | -3.5152 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 36.89 |
| InChI Key: | ZWPVJLNVHBFMHP-UHFFFAOYSA-N |