methyl 2-[1-(4-fluorophenyl)-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl]butanoate
Chemical Structure Depiction of
methyl 2-[1-(4-fluorophenyl)-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl]butanoate
methyl 2-[1-(4-fluorophenyl)-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl]butanoate
Compound characteristics
| Compound ID: | C801-0451 |
| Compound Name: | methyl 2-[1-(4-fluorophenyl)-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl]butanoate |
| Molecular Weight: | 330.32 |
| Molecular Formula: | C16 H15 F N4 O3 |
| Smiles: | CCC(C(=O)OC)N1C=Nc2c(cnn2c2ccc(cc2)F)C1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2841 |
| logD: | 2.2841 |
| logSw: | -2.525 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 60.826 |
| InChI Key: | VSOMEIPPCUDMJY-ZDUSSCGKSA-N |