3-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}-1-[4-(propan-2-yl)phenyl]pyrazin-2(1H)-one
Chemical Structure Depiction of
3-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}-1-[4-(propan-2-yl)phenyl]pyrazin-2(1H)-one
3-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}-1-[4-(propan-2-yl)phenyl]pyrazin-2(1H)-one
Compound characteristics
| Compound ID: | G195-0885 |
| Compound Name: | 3-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}-1-[4-(propan-2-yl)phenyl]pyrazin-2(1H)-one |
| Molecular Weight: | 392.52 |
| Molecular Formula: | C23 H24 N2 O2 S |
| Smiles: | CC(C)c1ccc(cc1)N1C=CN=C(C1=O)SCC(c1ccc(C)cc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6973 |
| logD: | 4.6973 |
| logSw: | -4.4561 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 36.89 |
| InChI Key: | KDURRKQAUAUKGR-UHFFFAOYSA-N |