2-({[4-(3,4-dimethylphenoxy)-6-ethylpyrimidin-2-yl]sulfanyl}methyl)benzonitrile
Chemical Structure Depiction of
2-({[4-(3,4-dimethylphenoxy)-6-ethylpyrimidin-2-yl]sulfanyl}methyl)benzonitrile
2-({[4-(3,4-dimethylphenoxy)-6-ethylpyrimidin-2-yl]sulfanyl}methyl)benzonitrile
Compound characteristics
| Compound ID: | V007-7609 |
| Compound Name: | 2-({[4-(3,4-dimethylphenoxy)-6-ethylpyrimidin-2-yl]sulfanyl}methyl)benzonitrile |
| Molecular Weight: | 375.49 |
| Molecular Formula: | C22 H21 N3 O S |
| Salt: | not_available |
| Smiles: | CCc1cc(nc(n1)SCc1ccccc1C#N)Oc1ccc(C)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.1659 |
| logD: | 6.1659 |
| logSw: | -5.6178 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.46 |
| InChI Key: | SAUPKTBQYOIQSA-UHFFFAOYSA-N |