N-(4-fluorophenyl)-2-{[(7-oxo-2-phenyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)methyl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-2-{[(7-oxo-2-phenyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)methyl]sulfanyl}acetamide
N-(4-fluorophenyl)-2-{[(7-oxo-2-phenyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)methyl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | G647-2056 |
| Compound Name: | N-(4-fluorophenyl)-2-{[(7-oxo-2-phenyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)methyl]sulfanyl}acetamide |
| Molecular Weight: | 409.44 |
| Molecular Formula: | C20 H16 F N5 O2 S |
| Smiles: | C(C1=CC(N2C(NC(c3ccccc3)=N2)=N1)=O)SCC(Nc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9609 |
| logD: | 2.9609 |
| logSw: | -3.5173 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.074 |
| InChI Key: | ASFDPCQRGPEZHO-UHFFFAOYSA-N |