3-({[4-ethyl-6-(4-fluorophenoxy)pyrimidin-2-yl]sulfanyl}methyl)benzonitrile
Chemical Structure Depiction of
3-({[4-ethyl-6-(4-fluorophenoxy)pyrimidin-2-yl]sulfanyl}methyl)benzonitrile
3-({[4-ethyl-6-(4-fluorophenoxy)pyrimidin-2-yl]sulfanyl}methyl)benzonitrile
Compound characteristics
| Compound ID: | V019-6720 |
| Compound Name: | 3-({[4-ethyl-6-(4-fluorophenoxy)pyrimidin-2-yl]sulfanyl}methyl)benzonitrile |
| Molecular Weight: | 365.43 |
| Molecular Formula: | C20 H16 F N3 O S |
| Salt: | not_available |
| Smiles: | CCc1cc(nc(n1)SCc1cccc(C#N)c1)Oc1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 5.0167 |
| logD: | 5.0166 |
| logSw: | -4.8329 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.46 |
| InChI Key: | HFKAPIOTZKVAMI-UHFFFAOYSA-N |