1-(3,5-dimethylphenyl)-3-{[(2-methylphenyl)methyl]sulfanyl}pyrazin-2(1H)-one
Chemical Structure Depiction of
1-(3,5-dimethylphenyl)-3-{[(2-methylphenyl)methyl]sulfanyl}pyrazin-2(1H)-one
1-(3,5-dimethylphenyl)-3-{[(2-methylphenyl)methyl]sulfanyl}pyrazin-2(1H)-one
Compound characteristics
Compound ID: | G195-0475 |
Compound Name: | 1-(3,5-dimethylphenyl)-3-{[(2-methylphenyl)methyl]sulfanyl}pyrazin-2(1H)-one |
Molecular Weight: | 336.45 |
Molecular Formula: | C20 H20 N2 O S |
Smiles: | Cc1cc(C)cc(c1)N1C=CN=C(C1=O)SCc1ccccc1C |
Stereo: | ACHIRAL |
logP: | 4.5894 |
logD: | 4.5894 |
logSw: | -4.3938 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 23.6427 |
InChI Key: | SYZVXPSJWXBSGN-UHFFFAOYSA-N |