1-(3,5-dimethylphenyl)-3-{[(3-methylphenyl)methyl]sulfanyl}pyrazin-2(1H)-one
Chemical Structure Depiction of
1-(3,5-dimethylphenyl)-3-{[(3-methylphenyl)methyl]sulfanyl}pyrazin-2(1H)-one
1-(3,5-dimethylphenyl)-3-{[(3-methylphenyl)methyl]sulfanyl}pyrazin-2(1H)-one
Compound characteristics
| Compound ID: | G195-0501 |
| Compound Name: | 1-(3,5-dimethylphenyl)-3-{[(3-methylphenyl)methyl]sulfanyl}pyrazin-2(1H)-one |
| Molecular Weight: | 336.45 |
| Molecular Formula: | C20 H20 N2 O S |
| Smiles: | Cc1cccc(CSC2C(N(C=CN=2)c2cc(C)cc(C)c2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.4358 |
| logD: | 4.4358 |
| logSw: | -4.4221 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 23.6427 |
| InChI Key: | AOAQQZNZHJKYKT-UHFFFAOYSA-N |