4-tert-butyl-2-{[(3-chlorophenyl)methyl]sulfanyl}-6-(3-fluorophenoxy)pyrimidine
Chemical Structure Depiction of
4-tert-butyl-2-{[(3-chlorophenyl)methyl]sulfanyl}-6-(3-fluorophenoxy)pyrimidine
4-tert-butyl-2-{[(3-chlorophenyl)methyl]sulfanyl}-6-(3-fluorophenoxy)pyrimidine
Compound characteristics
| Compound ID: | V002-0629 |
| Compound Name: | 4-tert-butyl-2-{[(3-chlorophenyl)methyl]sulfanyl}-6-(3-fluorophenoxy)pyrimidine |
| Molecular Weight: | 402.92 |
| Molecular Formula: | C21 H20 Cl F N2 O S |
| Salt: | not_available |
| Smiles: | CC(C)(C)c1cc(nc(n1)SCc1cccc(c1)[Cl])Oc1cccc(c1)F |
| Stereo: | ACHIRAL |
| logP: | 6.9133 |
| logD: | 6.9133 |
| logSw: | -6.4988 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 23.9083 |
| InChI Key: | BFWAPFDJHLAWKI-UHFFFAOYSA-N |