2-{5-[(4-fluorophenoxy)methyl]furan-2-yl}-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
2-{5-[(4-fluorophenoxy)methyl]furan-2-yl}-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
2-{5-[(4-fluorophenoxy)methyl]furan-2-yl}-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | Y500-4112 |
| Compound Name: | 2-{5-[(4-fluorophenoxy)methyl]furan-2-yl}-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 420.46 |
| Molecular Formula: | C22 H17 F N4 O2 S |
| Smiles: | C1CCc2c(C1)c1c3nc(c4ccc(COc5ccc(cc5)F)o4)nn3C=Nc1s2 |
| Stereo: | ACHIRAL |
| logP: | 4.9193 |
| logD: | 4.9192 |
| logSw: | -5.0094 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.645 |
| InChI Key: | XAGJCEZRVKYTAC-UHFFFAOYSA-N |