methyl [1-(4-fluorophenyl)-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl]acetate
Chemical Structure Depiction of
methyl [1-(4-fluorophenyl)-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl]acetate
methyl [1-(4-fluorophenyl)-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl]acetate
Compound characteristics
| Compound ID: | C801-0447 |
| Compound Name: | methyl [1-(4-fluorophenyl)-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl]acetate |
| Molecular Weight: | 302.26 |
| Molecular Formula: | C14 H11 F N4 O3 |
| Smiles: | COC(CN1C=Nc2c(cnn2c2ccc(cc2)F)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2836 |
| logD: | 1.2836 |
| logSw: | -2.16 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.14 |
| InChI Key: | BBFKJCDXEQZUMX-UHFFFAOYSA-N |