3-({[4-(2-methylphenoxy)-6-phenylpyrimidin-2-yl]sulfanyl}methyl)benzonitrile
Chemical Structure Depiction of
3-({[4-(2-methylphenoxy)-6-phenylpyrimidin-2-yl]sulfanyl}methyl)benzonitrile
3-({[4-(2-methylphenoxy)-6-phenylpyrimidin-2-yl]sulfanyl}methyl)benzonitrile
Compound characteristics
| Compound ID: | V026-9499 |
| Compound Name: | 3-({[4-(2-methylphenoxy)-6-phenylpyrimidin-2-yl]sulfanyl}methyl)benzonitrile |
| Molecular Weight: | 409.51 |
| Molecular Formula: | C25 H19 N3 O S |
| Salt: | not_available |
| Smiles: | Cc1ccccc1Oc1cc(c2ccccc2)nc(n1)SCc1cccc(C#N)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.4795 |
| logD: | 6.4795 |
| logSw: | -5.8922 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.78 |
| InChI Key: | KWHRKHFVUDKBFS-UHFFFAOYSA-N |