1-(2-hydroxyethyl)-6-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Chemical Structure Depiction of
1-(2-hydroxyethyl)-6-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
1-(2-hydroxyethyl)-6-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | F248-0021 |
| Compound Name: | 1-(2-hydroxyethyl)-6-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one |
| Molecular Weight: | 414.48 |
| Molecular Formula: | C19 H22 N6 O3 S |
| Smiles: | C1CN(CCN1C(CSC1NC(c2cnn(CCO)c2N=1)=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 0.6391 |
| logD: | 0.608 |
| logSw: | -2.2959 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.874 |
| InChI Key: | KFBWJFMCIPUSGE-UHFFFAOYSA-N |