2-(4-fluorophenoxy)-N-(5-{[(7-oxo-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide
Chemical Structure Depiction of
2-(4-fluorophenoxy)-N-(5-{[(7-oxo-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide
2-(4-fluorophenoxy)-N-(5-{[(7-oxo-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide
Compound characteristics
| Compound ID: | G647-3226 |
| Compound Name: | 2-(4-fluorophenoxy)-N-(5-{[(7-oxo-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide |
| Molecular Weight: | 433.44 |
| Molecular Formula: | C16 H12 F N7 O3 S2 |
| Smiles: | C(C(Nc1nnc(SCC2=CC(N3C(NC=N3)=N2)=O)s1)=O)Oc1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 1.5966 |
| logD: | 1.5966 |
| logSw: | -2.4607 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 106.091 |
| InChI Key: | MMBOKBQUEWJIQX-UHFFFAOYSA-N |