methyl {3-[(4-fluorophenyl)methyl]-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl}acetate
Chemical Structure Depiction of
methyl {3-[(4-fluorophenyl)methyl]-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl}acetate
methyl {3-[(4-fluorophenyl)methyl]-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl}acetate
Compound characteristics
| Compound ID: | C656-0154 |
| Compound Name: | methyl {3-[(4-fluorophenyl)methyl]-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl}acetate |
| Molecular Weight: | 317.28 |
| Molecular Formula: | C14 H12 F N5 O3 |
| Smiles: | COC(CN1C=Nc2c(C1=O)nnn2Cc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 0.3204 |
| logD: | 0.3204 |
| logSw: | -1.6252 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 73.872 |
| InChI Key: | YMHUUKNZPCWYHG-UHFFFAOYSA-N |