2-({[4-ethyl-6-(3-fluorophenoxy)pyrimidin-2-yl]sulfanyl}methyl)benzonitrile
Chemical Structure Depiction of
2-({[4-ethyl-6-(3-fluorophenoxy)pyrimidin-2-yl]sulfanyl}methyl)benzonitrile
2-({[4-ethyl-6-(3-fluorophenoxy)pyrimidin-2-yl]sulfanyl}methyl)benzonitrile
Compound characteristics
| Compound ID: | V021-9868 |
| Compound Name: | 2-({[4-ethyl-6-(3-fluorophenoxy)pyrimidin-2-yl]sulfanyl}methyl)benzonitrile |
| Molecular Weight: | 365.43 |
| Molecular Formula: | C20 H16 F N3 O S |
| Smiles: | CCc1cc(nc(n1)SCc1ccccc1C#N)Oc1cccc(c1)F |
| Stereo: | ACHIRAL |
| logP: | 5.2385 |
| logD: | 5.2385 |
| logSw: | -5.1411 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.46 |
| InChI Key: | RQGWXVAKADKLCD-UHFFFAOYSA-N |