N-(2-fluorophenyl)-2-{[5-(2-methoxyphenyl)-4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2-fluorophenyl)-2-{[5-(2-methoxyphenyl)-4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl}acetamide
N-(2-fluorophenyl)-2-{[5-(2-methoxyphenyl)-4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | K781-0749 |
| Compound Name: | N-(2-fluorophenyl)-2-{[5-(2-methoxyphenyl)-4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl}acetamide |
| Molecular Weight: | 425.44 |
| Molecular Formula: | C20 H16 F N5 O3 S |
| Smiles: | COc1ccccc1N1C(=Nc2c(cn[nH]2)C1=O)SCC(Nc1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2451 |
| logD: | 2.2436 |
| logSw: | -2.8771 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.207 |
| InChI Key: | ZCDDCVMXLSJSTF-UHFFFAOYSA-N |