ethyl [1-(4-chlorophenyl)-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl]acetate
Chemical Structure Depiction of
ethyl [1-(4-chlorophenyl)-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl]acetate
ethyl [1-(4-chlorophenyl)-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl]acetate
Compound characteristics
| Compound ID: | C801-0333 |
| Compound Name: | ethyl [1-(4-chlorophenyl)-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl]acetate |
| Molecular Weight: | 332.74 |
| Molecular Formula: | C15 H13 Cl N4 O3 |
| Smiles: | CCOC(CN1C=Nc2c(cnn2c2ccc(cc2)[Cl])C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.384 |
| logD: | 2.384 |
| logSw: | -3.0931 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 60.72 |
| InChI Key: | XTOWJWXFVROZAD-UHFFFAOYSA-N |