N-(4-fluorophenyl)-2-{[(4-fluorophenyl)methyl]sulfanyl}-5-(phenylsulfanyl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-2-{[(4-fluorophenyl)methyl]sulfanyl}-5-(phenylsulfanyl)pyrimidine-4-carboxamide
N-(4-fluorophenyl)-2-{[(4-fluorophenyl)methyl]sulfanyl}-5-(phenylsulfanyl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D506-0187 |
| Compound Name: | N-(4-fluorophenyl)-2-{[(4-fluorophenyl)methyl]sulfanyl}-5-(phenylsulfanyl)pyrimidine-4-carboxamide |
| Molecular Weight: | 465.54 |
| Molecular Formula: | C24 H17 F2 N3 O S2 |
| Smiles: | [H]N(C(c1c(cnc(n1)SCc1ccc(cc1)F)Sc1ccccc1)=O)c1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 5.9244 |
| logD: | 5.9229 |
| logSw: | -5.7303 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.372 |
| InChI Key: | VOKHCGSBKYRQTG-UHFFFAOYSA-N |