ethyl 4-{[1-(4-fluorophenyl)-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl]methyl}-5-methyl-1,2-oxazole-3-carboxylate
Chemical Structure Depiction of
ethyl 4-{[1-(4-fluorophenyl)-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl]methyl}-5-methyl-1,2-oxazole-3-carboxylate
ethyl 4-{[1-(4-fluorophenyl)-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl]methyl}-5-methyl-1,2-oxazole-3-carboxylate
Compound characteristics
| Compound ID: | Y504-5224 |
| Compound Name: | ethyl 4-{[1-(4-fluorophenyl)-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl]methyl}-5-methyl-1,2-oxazole-3-carboxylate |
| Molecular Weight: | 397.36 |
| Molecular Formula: | C19 H16 F N5 O4 |
| Smiles: | CCOC(c1c(CN2C=Nc3c(cnn3c3ccc(cc3)F)C2=O)c(C)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3807 |
| logD: | 2.3807 |
| logSw: | -2.6217 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 83.275 |
| InChI Key: | XLZNUVSDCPQCOS-UHFFFAOYSA-N |