4-(2-fluorophenoxy)-2-{[(4-nitrophenyl)methyl]sulfanyl}-6-(propan-2-yl)pyrimidine
Chemical Structure Depiction of
4-(2-fluorophenoxy)-2-{[(4-nitrophenyl)methyl]sulfanyl}-6-(propan-2-yl)pyrimidine
4-(2-fluorophenoxy)-2-{[(4-nitrophenyl)methyl]sulfanyl}-6-(propan-2-yl)pyrimidine
Compound characteristics
| Compound ID: | V004-0786 |
| Compound Name: | 4-(2-fluorophenoxy)-2-{[(4-nitrophenyl)methyl]sulfanyl}-6-(propan-2-yl)pyrimidine |
| Molecular Weight: | 399.44 |
| Molecular Formula: | C20 H18 F N3 O3 S |
| Salt: | not_available |
| Smiles: | CC(C)c1cc(nc(n1)SCc1ccc(cc1)[N+]([O-])=O)Oc1ccccc1F |
| Stereo: | ACHIRAL |
| logP: | 5.6902 |
| logD: | 5.6902 |
| logSw: | -5.5275 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.376 |
| InChI Key: | ZALIGJGCWGTNRV-UHFFFAOYSA-N |