2-({[4-(2,4-dimethylphenoxy)-6-methylpyrimidin-2-yl]sulfanyl}methyl)benzonitrile
Chemical Structure Depiction of
2-({[4-(2,4-dimethylphenoxy)-6-methylpyrimidin-2-yl]sulfanyl}methyl)benzonitrile
2-({[4-(2,4-dimethylphenoxy)-6-methylpyrimidin-2-yl]sulfanyl}methyl)benzonitrile
Compound characteristics
| Compound ID: | V022-7518 |
| Compound Name: | 2-({[4-(2,4-dimethylphenoxy)-6-methylpyrimidin-2-yl]sulfanyl}methyl)benzonitrile |
| Molecular Weight: | 361.46 |
| Molecular Formula: | C21 H19 N3 O S |
| Smiles: | Cc1ccc(c(C)c1)Oc1cc(C)nc(n1)SCc1ccccc1C#N |
| Stereo: | ACHIRAL |
| logP: | 5.5884 |
| logD: | 5.5884 |
| logSw: | -5.5595 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.858 |
| InChI Key: | PUDIBJGEGVHDAJ-UHFFFAOYSA-N |