2-{[(4-fluorophenyl)methyl]sulfanyl}-4-(4-nitrophenoxy)-6-(propan-2-yl)pyrimidine
Chemical Structure Depiction of
2-{[(4-fluorophenyl)methyl]sulfanyl}-4-(4-nitrophenoxy)-6-(propan-2-yl)pyrimidine
2-{[(4-fluorophenyl)methyl]sulfanyl}-4-(4-nitrophenoxy)-6-(propan-2-yl)pyrimidine
Compound characteristics
| Compound ID: | V020-2756 |
| Compound Name: | 2-{[(4-fluorophenyl)methyl]sulfanyl}-4-(4-nitrophenoxy)-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)F)Oc1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.5535 |
| logD: | 5.5535 |
| logSw: | -5.4552 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.29 |
| InChI Key: | PIKUGFGCIMDSOY-UHFFFAOYSA-N |